Model name: model_name=EMT_Asap_Standard_JacobsenStoltzeNorskov_1996_Ag__MO_303974873468_001
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ag
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.063553899526596
cohesive_energy=2.9605994760773475
mass=107.8682
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.067777026435836e-19, 1.60671079387422e-19, 2.03966698568004e-19, 2.40794330677128e-19, 2.72206605763332e-19, 2.99573384848686e-19, 3.23638077891366e-19, 3.4490376835444795e-19, 3.63746967746922e-19, 3.80454465686274e-19, 3.9526178213770194e-19, 4.0836278047391995e-19, 4.1995292624427596e-19, 4.3027895465040597e-19, 4.395219116519519e-19, 4.4756003182473e-19, 4.54324421573478e-19, 4.599384484990139e-19, 4.6452067367225395e-19, 4.68157614631434e-19, 4.70906949735378e-19, 4.7281834645974e-19, 4.739382679269059e-19, 4.74303564199458e-19, 4.739094287474939e-19, 4.72635698323464e-19, 4.70322155263968e-19, 4.66781344902828e-19, 4.61788962511284e-19, 4.55083853297994e-19, 4.463744211155699e-19, 4.353113914578e-19, 4.2137405691863396e-19, 4.03871879368818e-19, 3.8207106190998e-19, 3.55101622629858e-19, 3.2185325312108994e-19, 2.80916037945756e-19, 2.30492334920508e-19, 1.6835031199418399e-19, 9.181721810594519e-20, -3.3181078090139995e-21, -1.227616576150212e-19, -2.7341144259209996e-19, -4.649228200073879e-19, -7.108008571441979e-19, -1.0311064076368439e-18, -1.4538471212242799e-18, -2.0212259326227e-18, -2.8034886741732e-18, -3.90734030970018e-18, -5.51047824968058e-18, -7.91720390221002e-18, -1.1602658769867538e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: -1.75621268201409e-24 eV

========================================
theta = 0.0
========================================

Energy: 0.009036188347515073
Energy: 0.009414370666969214
Energy: 0.00936088865499591
Energy: 0.009213284265525788
Energy: 0.2737288911559589
Energy: 0.00931828985655022
Energy: 0.009414370666969214
Energy: 0.07618985077565442
Energy: 0.07619308390260347
Energy: 0.07621175503749189
Energy: 0.07621246754677756
Energy: 0.07614840322650214
Energy: 0.00936088865499591
Energy: 0.07619308390260347
Energy: 0.07626036510240268
Energy: 0.009365144589303907
Energy: 0.0760882150695975
Energy: 0.07677375321443577
Energy: 0.009213284265525788
Energy: 0.07621175503749189
Energy: 0.009365144589303907
Energy: 0.009237190813021472
Energy: 0.07622218046818685
Energy: 0.00934435866422571
Energy: 0.2737288911559589
Energy: 0.07621246754677756
Energy: 0.0760882150693493
Energy: 0.07622218046818685
Energy: 0.0765658852237917
Energy: 0.07617102846433567
Energy: 0.00931828985655022
Energy: 0.07614840322650214
Energy: 0.07677375321420138
Energy: 0.00934435866422571
Energy: 0.07617102846433567
Energy: 0.009404616052666624

minimum gb energy = 0.009036188347515073 eV
minimum distance =  2.86807301624475 Angstroms
sigma value = 1


========================================
theta = 20.049975724151484
========================================

Energy: 0.8043592341875917
Energy: 0.5599515765537035
Energy: 0.5961540814167265
Energy: 0.5298611044651654
Energy: 0.8009687266916794
Energy: 0.5846556592848239
Energy: 0.7913228689457157
Energy: 0.5598775970308167
Energy: 0.5596994447415226
Energy: 0.5628819217114134
Energy: 0.559764542541893
Energy: 0.538959539928779
Energy: 0.6747183181960047
Energy: 0.55986208313179
Energy: 0.5484276272467151
Energy: 0.5612528933435089
Energy: 0.5597052442282012
Energy: 0.5427314381611102
Energy: 0.8264972620226231
Energy: 0.5479425246441919
Energy: 0.542300896165959
Energy: 0.5484347674388811
Energy: 0.5507809615000419
Energy: 0.558366591036991
Energy: 0.7562869524164249
Energy: 0.5501773576141318
Energy: 0.5647689324598145
Energy: 0.5096648004411467
Energy: 0.5414166002072401
Energy: 0.565077552884088
Energy: 0.7450837698868542
Energy: 0.5628129059923905
Energy: 0.5626859980443268
Energy: 0.5501087380188157
Energy: 0.5627125289480036
Energy: 0.5630249098491228
Energy: 0.7456604528048308
Energy: 0.5277351634419498
Energy: 0.5597337983466074
Energy: 0.5590388286328468
Energy: 0.5269716915954356
Energy: 0.5598299429379837
Energy: 0.7104115673258312
Energy: 0.5588085869964639
Energy: 0.5587639468104731
Energy: 0.5279257891535971
Energy: 0.5592195650419449
Energy: 0.5603329066722116
Energy: 0.6108721806024446
Energy: 0.5508958250916873
Energy: 0.5602243834530836
Energy: 0.5618770968338087
Energy: 0.561289956581007
Energy: 0.561436902441076
Energy: 0.6108569092913978
Energy: 0.5610269828466966
Energy: 0.5607144202885368
Energy: 0.5394317606220186
Energy: 0.5618253599827596
Energy: 0.550254703686788
Energy: 0.6444246178594415
Energy: 0.5583059331906203
Energy: 0.5263442379859694
Energy: 0.5844788645545028
Energy: 0.5569817683632221
Energy: 0.5498700563599032
Energy: 0.5601603682634876
Energy: 0.5368981056731709
Energy: 0.5445959417690975
Energy: 0.5603799906847639
Energy: 0.5608175210069438
Energy: 0.5474184470760588
Energy: 0.559820910103939
Energy: 0.539782972650439
Energy: 0.5593055708962225
Energy: 0.559896433647705
Energy: 0.5616889930005814
Energy: 0.5309067568697221
Energy: 0.6147536495093088
Energy: 0.5550426201610188
Energy: 0.5416215318309897
Energy: 0.5712085624166022
Energy: 0.5574196115918334
Energy: 0.5424895168932589
Energy: 0.5772016372703354
Energy: 0.561246500423603
Energy: 0.5497743136283358
Energy: 0.5494241620437594
Energy: 0.5469154707612767
Energy: 0.5317668777458591
Energy: 0.5769171128006978
Energy: 0.5454413702597545
Energy: 0.5567571877502439
Energy: 0.5652530757633873
Energy: 0.5540546896974741
Energy: 0.5643959556306871
Energy: 0.671633971164471
Energy: 0.5589710407179158
Energy: 0.5590244263778105
Energy: 0.5640670218405901
Energy: 0.5591576135285876
Energy: 0.5545991114542883
Energy: 0.6730948183772653
Energy: 0.5261871398324199
Energy: 0.5616891710679923
Energy: 0.5607751728987682
Energy: 0.5044478982719826
Energy: 0.5613598290477532
Energy: 0.674373907035073
Energy: 0.562174115968309
Energy: 0.5606938830082213
Energy: 0.5549056451017655
Energy: 0.5610529545212375
Energy: 0.5605261422359455
Energy: 0.6755912691232047
Energy: 0.562822464875618
Energy: 0.5611649162104978
Energy: 0.5108585061896106
Energy: 0.5541744739018242
Energy: 0.5606025852439153
Energy: 0.802844784433163
Energy: 0.5390493040614256
Energy: 0.5262678566094308
Energy: 0.5560510968321494
Energy: 0.5562404698583587
Energy: 0.5290855042871123
Energy: 0.6319516625167908
Energy: 0.5652432203475017
Energy: 0.5648690947532382
Energy: 0.5610144854071315
Energy: 0.5642560642886689
Energy: 0.5595198519054763
Energy: 0.7915602422863799
Energy: 0.5473740299691294
Energy: 0.5474984994675132
Energy: 0.5616314482878295
Energy: 0.5474790812867879
Energy: 0.5479626610777568

minimum gb energy = 0.5044478982719826 eV
minimum distance =  2.68266084784624 Angstroms
sigma value = 33


========================================
theta = 22.84350731792459
========================================

Energy: 0.9072542034791939
Energy: 0.6209891163658134
Energy: 0.580739313662419
Energy: 0.5813473338736017
Energy: 0.6053098148818014
Energy: 0.5970598979763951
Energy: 0.666199535953404
Energy: 0.5682899801222497
Energy: 0.5649631429493511
Energy: 0.5732087236660748
Energy: 0.5687549357104754
Energy: 0.5496350164218861
Energy: 0.7158194782981401
Energy: 0.5679722275021821
Energy: 0.5667757186679176
Energy: 0.5973150900527009
Energy: 0.5615155161121508
Energy: 0.5413322628030282
Energy: 0.7810550849588973
Energy: 0.5901071593730948
Energy: 0.5624016558686914
Energy: 0.5840214853651309
Energy: 0.5936180266240454
Energy: 0.5834440578371721
Energy: 0.7277830420542594
Energy: 0.5971842301673618
Energy: 0.5790506931428787
Energy: 0.5730670629207002
Energy: 0.5722728882562744
Energy: 0.6048798323752221
Energy: 0.7758912089095829
Energy: 0.608166777068191
Energy: 0.6069131311168133
Energy: 0.5690634727961936
Energy: 0.608122518058759
Energy: 0.5966876664778477
Energy: 0.7741826835607015
Energy: 0.5958450203257121
Energy: 0.595101220324114
Energy: 0.5949251551248343
Energy: 0.6053589520929473
Energy: 0.594106471636666
Energy: 0.7279832993952495
Energy: 0.5823703012069845
Energy: 0.5829308583028486
Energy: 0.5712501482567507
Energy: 0.5821032535340629
Energy: 0.5823308869050242
Energy: 0.637574327148087
Energy: 0.5812961807401886
Energy: 0.5923832346850186
Energy: 0.6068720022316576
Energy: 0.5812913188523581
Energy: 0.605891840604788
Energy: 0.6368027701102703
Energy: 0.5996460466222375
Energy: 0.5987970609641641
Energy: 0.6054988213795288
Energy: 0.5992174194544292
Energy: 0.6050240913508331
Energy: 0.6784073399044221
Energy: 0.5385379105667376
Energy: 0.5385807104366516
Energy: 0.5669879588817984
Energy: 0.5388169501782901
Energy: 0.5388064391525542
Energy: 0.5959293700145616
Energy: 0.5460766320465924
Energy: 0.6020183833199253
Energy: 0.5959977965489728
Energy: 0.5642906980977996
Energy: 0.5980942191432895
Energy: 0.5953692384505924
Energy: 0.5992850552833366
Energy: 0.5915887172510951
Energy: 0.5952937290907324
Energy: 0.6061774421549967
Energy: 0.5934338698204099
Energy: 0.6649975261935733
Energy: 0.5739153304690696
Energy: 0.5731790511818835
Energy: 0.6605504355488032
Energy: 0.5836042183823512
Energy: 0.5835681020137219
Energy: 0.6317336885689164
Energy: 0.6016363515661001
Energy: 0.5842241624264177
Energy: 0.5944786568304308
Energy: 0.6012567198708887
Energy: 0.6055126051478491
Energy: 0.6335575539941827
Energy: 0.5970398295473004
Energy: 0.5949105118870038
Energy: 0.6060407606672455
Energy: 0.5878516543342777
Energy: 0.6075055767038132
Energy: 0.7302048603667164
Energy: 0.5949299276950138
Energy: 0.5949498296346927
Energy: 0.5961177070789921
Energy: 0.595226410232888
Energy: 0.5949007902801263
Energy: 0.665564934265488
Energy: 0.58670017229453
Energy: 0.5871855543433081
Energy: 0.5813806472152699
Energy: 0.6055850418422646
Energy: 0.5815636492096962
Energy: 0.6655712002473038
Energy: 0.6068024183252804
Energy: 0.6033433484194316
Energy: 0.5812453556784121
Energy: 0.607621879934268
Energy: 0.6015709576101956
Energy: 0.7397497415289944
Energy: 0.6039709766372261
Energy: 0.6036052230665988
Energy: 0.6031316568037709
Energy: 0.6044887432362976
Energy: 0.5962371909494442
Energy: 0.8391452337309617
Energy: 0.590589271763821
Energy: 0.5382362313347188
Energy: 0.5385617274012042
Energy: 0.6423967902511339
Energy: 0.5381411788383345
Energy: 0.6442093132446646
Energy: 0.5977026649344933
Energy: 0.5993492892840673
Energy: 0.5641881939400716
Energy: 0.5953287286467742
Energy: 0.5976893971209634
Energy: 0.7400630447152419
Energy: 0.5955436027379772
Energy: 0.597696857724075
Energy: 0.607091137559102
Energy: 0.5957873664507864
Energy: 0.5955152370360749
Energy: 0.7828474255853058
Energy: 0.6583804125397084
Energy: 0.6512922373009371
Energy: 0.5726170779301143
Energy: 0.6637750510424693
Energy: 0.5921685091186023
Energy: 0.7305622944377177
Energy: 0.5784046754088988
Energy: 0.5785210968141457
Energy: 0.6049935975281983
Energy: 0.5904393004887936
Energy: 0.6043907588426195
Energy: 0.7283353072501866
Energy: 0.6048654820198942
Energy: 0.6064107872095922
Energy: 0.6012218197824444
Energy: 0.6050445486233172
Energy: 0.6056037524353854
Energy: 0.7730211675186696
Energy: 0.5943170768359183
Energy: 0.5953672749732581
Energy: 0.5951195614420491
Energy: 0.5963555910953138
Energy: 0.5955796732134367
Energy: 0.7291840249838517
Energy: 0.5812501247554426
Energy: 0.5817491367370706
Energy: 0.5858785161014057
Energy: 0.5812986170270704
Energy: 0.5825033479521073
Energy: 0.6387678110330792
Energy: 0.5815117302622074
Energy: 0.5816309768044906
Energy: 0.607854984349287
Energy: 0.5813808318433024
Energy: 0.6002103817336213
Energy: 0.6365799036153043
Energy: 0.6004712142308697
Energy: 0.5913203825098686
Energy: 0.6039455495780768
Energy: 0.6010151020403227
Energy: 0.6010805824735513
Energy: 0.6666405157047213
Energy: 0.5382504393299076
Energy: 0.5381823224616663
Energy: 0.5975697997122029
Energy: 0.5384358050993509
Energy: 0.5380294777895964
Energy: 0.5956394725497866
Energy: 0.5377390908222766
Energy: 0.5285526647532588
Energy: 0.5956764487917849
Energy: 0.5465442281957834
Energy: 0.5829226284734818
Energy: 0.5968282404253519
Energy: 0.599924222508918
Energy: 0.5644819385391432
Energy: 0.5969299064344941
Energy: 0.6007134957627975
Energy: 0.5979480871129303
Energy: 0.6002370599605779
Energy: 0.5731553584579117
Energy: 0.572798662999626
Energy: 0.6006040005880793
Energy: 0.5835277571069608
Energy: 0.5928968446655194
Energy: 0.6308977472733113
Energy: 0.6024390013135561
Energy: 0.6024057889674022
Energy: 0.5816711601972729
Energy: 0.6055982015925494
Energy: 0.594025045515448
Energy: 0.6309173761239582
Energy: 0.5860301176608808
Energy: 0.6056554270270116
Energy: 0.6056918945284121
Energy: 0.5960358358586656
Energy: 0.6059587215909693
Energy: 0.6314550633311637
Energy: 0.5962887632155064
Energy: 0.5525185438206461
Energy: 0.5693558474068562
Energy: 0.5518845916017513
Energy: 0.5958611051728119
Energy: 0.6655668359386083
Energy: 0.5981115659833933
Energy: 0.5612602664629275
Energy: 0.5813831260227464
Energy: 0.5664223487576349
Energy: 0.5956071837993366
Energy: 0.669008454734873
Energy: 0.5844944046565421
Energy: 0.5713669196796388
Energy: 0.5815944985675437
Energy: 0.5783940432515792
Energy: 0.581890507835262
Energy: 0.7368364394257612
Energy: 0.5751825490099116
Energy: 0.5692336389209277
Energy: 0.5757934444302653
Energy: 0.5756509670505239
Energy: 0.5658538401135844
Energy: 0.8635704784271987
Energy: 0.559638983666596
Energy: 0.5449476161196234
Energy: 0.5385286902678545
Energy: 0.5681226056875134
Energy: 0.5587545724606569

minimum gb energy = 0.5285526647532588 eV
minimum distance =  2.67446081257573 Angstroms
sigma value = 51


========================================
theta = 26.525352016609688
========================================

Energy: 0.8379204224429433
Energy: 0.5500326777583755
Energy: 0.5506546744403739
Energy: 0.5454660299106736
Energy: 0.5866631214689455
Energy: 0.5846700516591297
Energy: 0.6969801402938037
Energy: 0.57672430618464
Energy: 0.5768023683413039
Energy: 0.5320697972334215
Energy: 0.5765774114978117
Energy: 0.5629524373045888
Energy: 0.7109551808849904
Energy: 0.5769727507815557
Energy: 0.5770299714188786
Energy: 0.5500605341372764
Energy: 0.5768769264670367
Energy: 0.5504458966859909
Energy: 0.7665225561769281
Energy: 0.5508655341548894
Energy: 0.5509369117984618
Energy: 0.5712190063829778
Energy: 0.5510619707843023
Energy: 0.5680343305212275
Energy: 0.6576561716520356
Energy: 0.5841564540341887
Energy: 0.5845670761591444
Energy: 0.5565098596005167
Energy: 0.5838509316161633
Energy: 0.572216756921498
Energy: 0.6570043490989953
Energy: 0.5830983789186578
Energy: 0.5819434441001724
Energy: 0.5824074593583343
Energy: 0.5826909086926565
Energy: 0.5825644902021951
Energy: 0.6569776926928765
Energy: 0.5752102978567375
Energy: 0.5738833896092557
Energy: 0.5839043159231074
Energy: 0.5872183438040046
Energy: 0.5846098320075582
Energy: 0.6750607782817711
Energy: 0.5524217207557783
Energy: 0.5523205041406943
Energy: 0.5526933982073766
Energy: 0.5528332146217033
Energy: 0.552271623667896
Energy: 0.5770445602484406
Energy: 0.5495593421478017
Energy: 0.5500911217618387
Energy: 0.5769997611053893
Energy: 0.5517355468486473
Energy: 0.5504816449659985
Energy: 0.5769259381233325
Energy: 0.5674364751341014
Energy: 0.5538360031901242
Energy: 0.5769802242671026
Energy: 0.5290101036221734
Energy: 0.5771322685870214
Energy: 0.6011239921514169
Energy: 0.5485088316282094
Energy: 0.54884333401365
Energy: 0.6013300967556995
Energy: 0.5482608732838871
Energy: 0.5756444031012848
Energy: 0.5984340883119055
Energy: 0.5659708634047513
Energy: 0.5892169709183025
Energy: 0.5631474968335284
Energy: 0.547777887373765
Energy: 0.5631489046728408
Energy: 0.5993896982266562
Energy: 0.5612483669307508
Energy: 0.5617086865081086
Energy: 0.58687667866618
Energy: 0.5588588640863528
Energy: 0.5622731973447097
Energy: 0.5986456403259681
Energy: 0.5719060157595525
Energy: 0.5597722124075604
Energy: 0.5867034459647248
Energy: 0.5415075522228503
Energy: 0.53612328866111
Energy: 0.694788210985381
Energy: 0.5587973981350081
Energy: 0.5588255028749946
Energy: 0.5640968267231082
Energy: 0.5623464995160028
Energy: 0.5588438541894744
Energy: 0.6958865855172132
Energy: 0.5869389219312997
Energy: 0.5872318149944462
Energy: 0.5704648817749001
Energy: 0.5870362382143904
Energy: 0.5718533777997304
Energy: 0.7155304303843077
Energy: 0.5871361112483112
Energy: 0.5871212285148952
Energy: 0.5565747873222191
Energy: 0.5881090961270772
Energy: 0.5756931218972576
Energy: 0.8404783264150775
Energy: 0.5634998680458956
Energy: 0.5556528664154649
Energy: 0.5512062638559456
Energy: 0.5631669576117048
Energy: 0.541902702466068

minimum gb energy = 0.5290101036221734 eV
minimum distance =  2.70716744701008 Angstroms
sigma value = 19


========================================
theta = 31.586338096527925
========================================

Energy: 0.7122473681629283
Energy: 0.5551294525597679
Energy: 0.5367990898583379
Energy: 0.5917200022207308
Energy: 0.5486197004374677
Energy: 0.5355151408590713
Energy: 0.5297202023926236
Energy: 0.547032983059517
Energy: 0.5469622407240895
Energy: 0.5591339493446811
Energy: 0.5470291638914802
Energy: 0.5469549960043016
Energy: 0.6268876019372278
Energy: 0.5468740130686635
Energy: 0.5469007027509657
Energy: 0.5594545712380379
Energy: 0.5469453902614531
Energy: 0.547157930995603
Energy: 0.6199017163949534
Energy: 0.5469673481045072
Energy: 0.5471498950985733
Energy: 0.5491004821136145
Energy: 0.5471045591427396
Energy: 0.5471969227915158
Energy: 0.6084357833876016
Energy: 0.5471016046797799
Energy: 0.5472475599918539
Energy: 0.5695939540342261
Energy: 0.5469547088113957
Energy: 0.5693144430730895
Energy: 0.6270658639916692
Energy: 0.5306449500424596
Energy: 0.5684716831172013
Energy: 0.5611177877243501
Energy: 0.5304322991969811
Energy: 0.5644221508888837
Energy: 0.6270264191022606
Energy: 0.5699985606705417
Energy: 0.558854978137224
Energy: 0.5601897413736129
Energy: 0.5375591078014446
Energy: 0.5584460766752382
Energy: 0.6101717003640504
Energy: 0.5082029524474456
Energy: 0.5084001554413017
Energy: 0.6081339372632167
Energy: 0.5081832697819064
Energy: 0.5202165427031124
Energy: 0.5469497846215118
Energy: 0.5082325588108642
Energy: 0.5080800440944956
Energy: 0.5468475884249745
Energy: 0.5082247684600476
Energy: 0.5196970598958607
Energy: 0.5475510977468846
Energy: 0.5480891918547476
Energy: 0.5473237822041557
Energy: 0.5460918288472786
Energy: 0.5595482809467043
Energy: 0.5471542894623684
Energy: 0.5466086349578031
Energy: 0.550096817832979
Energy: 0.5705814441533013
Energy: 0.5466229652844763
Energy: 0.5523415633130121
Energy: 0.5467871663172093
Energy: 0.6268892270905604
Energy: 0.5603237488566601
Energy: 0.5689497221999605
Energy: 0.5466171321724479
Energy: 0.5594084940672716
Energy: 0.5471249689445848
Energy: 0.5296951866010127
Energy: 0.5599556326612503
Energy: 0.5705486178853214
Energy: 0.5296575151702895
Energy: 0.5595942913357984
Energy: 0.5615237432210727
Energy: 0.6283641933415456
Energy: 0.5612026079554495
Energy: 0.5613211689164405
Energy: 0.5474715300518447
Energy: 0.5598397862600522
Energy: 0.5606225537500801
Energy: 0.7145643041420654
Energy: 0.538268329458441
Energy: 0.5378965170949848
Energy: 0.5082930475514231
Energy: 0.5466196542583709
Energy: 0.5078262023411277
Energy: 0.714508461813503
Energy: 0.5474619436310344
Energy: 0.5205427417015936
Energy: 0.5082871674059526
Energy: 0.5472945255685793
Energy: 0.5086492014666545
Energy: 0.6070739137030783
Energy: 0.5468675038306879
Energy: 0.5470230641979641
Energy: 0.5702504278760288
Energy: 0.5467284969628793
Energy: 0.5472081816619357
Energy: 0.6192207274244015
Energy: 0.5468912098671878
Energy: 0.5468277836426946
Energy: 0.5499467220035268
Energy: 0.5468349892053668
Energy: 0.5469807579638879
Energy: 0.6191979925168047
Energy: 0.5469763073519267
Energy: 0.5470053441304286
Energy: 0.5518734055867869
Energy: 0.5469991876075203
Energy: 0.5470338838396976
Energy: 0.6296152756647188
Energy: 0.5303555805050794
Energy: 0.5691017467944884
Energy: 0.5754228445465515
Energy: 0.5302593670657217
Energy: 0.5688410686875244
Energy: 0.6249506372227491
Energy: 0.5594588093748512
Energy: 0.5702386643663189
Energy: 0.559160507472849
Energy: 0.5473042519614
Energy: 0.5610366401004836
Energy: 0.6274400508555255
Energy: 0.5700552658433828
Energy: 0.5698128421681035
Energy: 0.5594392979504357
Energy: 0.5282340885551681
Energy: 0.5696402229127958
Energy: 0.6077177365236496
Energy: 0.5080154835448598
Energy: 0.5080417481657965
Energy: 0.607571364367324
Energy: 0.5081844576606942
Energy: 0.5355591879093156
Energy: 0.5468924162034244
Energy: 0.5392082763185974
Energy: 0.5473488037615579
Energy: 0.5468953034687529
Energy: 0.5476320395232245
Energy: 0.5467521764984473
Energy: 0.5469374721093262
Energy: 0.5387449225711277
Energy: 0.5472372896210145
Energy: 0.5469442567126303
Energy: 0.5595469929654213
Energy: 0.546979513420062
Energy: 0.6078587808355909
Energy: 0.5519199821137757
Energy: 0.5521239016207352
Energy: 0.607596344261687
Energy: 0.5495532052097694
Energy: 0.547151757571664
Energy: 0.6266572804618291
Energy: 0.5711660428016846
Energy: 0.5690379150136613
Energy: 0.5471752482354191
Energy: 0.5601925976853958
Energy: 0.5696444686813362
Energy: 0.5298260347986748
Energy: 0.5598676016979406
Energy: 0.5590193198617971
Energy: 0.5301236122561325
Energy: 0.5602368463630732
Energy: 0.5685320946443112
Energy: 0.60906476160312
Energy: 0.5596374725269624
Energy: 0.5590041059753202
Energy: 0.5375517343807718
Energy: 0.5601853364702405
Energy: 0.5585989220705413
Energy: 0.7145435287966967
Energy: 0.5475514312318983
Energy: 0.5203814360574714
Energy: 0.5079849586916424
Energy: 0.547417248459418
Energy: 0.5082937824230743

minimum gb energy = 0.5078262023411277 eV
minimum distance =  2.75336138984631 Angstroms
sigma value = 27


========================================
theta = 38.94244126898138
========================================

Energy: 0.6187281982486051
Energy: 0.6232093896073898
Energy: 0.6706756917895993
Energy: 0.4790442832585231
Energy: 0.5438803502756393
Energy: 0.673408997408274
Energy: 0.5616862797923337
Energy: 0.543538629661455
Energy: 0.5441873407376843
Energy: 0.519222369282953
Energy: 0.5436583105662556
Energy: 0.49857461841733636
Energy: 0.5666445232056797
Energy: 0.5429882845260929
Energy: 0.5428029738551966
Energy: 0.49909166238323366
Energy: 0.5418424338445667
Energy: 0.4994889503603615
Energy: 0.5069146912731601
Energy: 0.517371435713549
Energy: 0.48749968780673625
Energy: 0.49942281750021994
Energy: 0.5690724881566379
Energy: 0.48724971037497145
Energy: 0.6238040111676023
Energy: 0.4821789887794086
Energy: 0.4985219650794395
Energy: 0.517951320890132
Energy: 0.4816194436211661
Energy: 0.48647510481793776
Energy: 0.5429337278702994
Energy: 0.4825242633462939
Energy: 0.48309034326105
Energy: 0.5429304720887923
Energy: 0.4817377824795387
Energy: 0.4714991058478817
Energy: 0.5436505597475163
Energy: 0.49855022178338104
Energy: 0.4982756754632252
Energy: 0.5440325978966326
Energy: 0.5001587800000792
Energy: 0.49810947933062305
Energy: 0.5441201125486134
Energy: 0.49950903351163894
Energy: 0.5675927650765933
Energy: 0.544118749068573
Energy: 0.5001015115561355
Energy: 0.5677551376337581
Energy: 0.5668209983519316
Energy: 0.49541192304229476
Energy: 0.4872468351268826
Energy: 0.5440399844755237
Energy: 0.5179459598787532
Energy: 0.49829533405657433
Energy: 0.5670922884663385
Energy: 0.4984511683935847
Energy: 0.497925581805027
Energy: 0.5267043325044118
Energy: 0.524062314284968
Energy: 0.4986797662781677
Energy: 0.5667540795974326
Energy: 0.5379651485265683
Energy: 0.5117592373958006
Energy: 0.523445003049982
Energy: 0.5387528743824886
Energy: 0.5095415893657015
Energy: 0.5669393116658593
Energy: 0.5098382506548369
Energy: 0.5085068212610753
Energy: 0.5188795743914857
Energy: 0.5430682054133696
Energy: 0.5088013837455607

minimum gb energy = 0.4714991058478817 eV
minimum distance =  2.72133887375835 Angstroms
sigma value = 9


========================================
theta = 44.00342734889962
========================================

Energy: 0.8850944044684411
Energy: 0.5559316216181532
Energy: 0.6014451577293191
Energy: 0.5123319593377589
Energy: 0.47355053452650553
Energy: 0.512806575049989
Energy: 0.4786328710766327
Energy: 0.4717178215527269
Energy: 0.47083212260136803
Energy: 0.4565165053970616
Energy: 0.4711031226710738
Energy: 0.4511474510990779
Energy: 0.48296870011766496
Energy: 0.4718362865779333
Energy: 0.45605940150984403
Energy: 0.456373648374298
Energy: 0.4709701226519971
Energy: 0.4561318777110381
Energy: 0.609965296391718
Energy: 0.44882590013760504
Energy: 0.44877823610543516
Energy: 0.45600693482885984
Energy: 0.4713331545371806
Energy: 0.43869668937119716
Energy: 0.5133092047050289
Energy: 0.45772982444801497
Energy: 0.430785232581608
Energy: 0.4757620962029379
Energy: 0.45716701415947864
Energy: 0.44970939622124234
Energy: 0.4836141461111216
Energy: 0.4460291616037429
Energy: 0.43633108089948286
Energy: 0.48376652184100244
Energy: 0.4631732090811673
Energy: 0.463195442191239
Energy: 0.4846219884096813
Energy: 0.43952939133524416
Energy: 0.4391141296468477
Energy: 0.48533288768816596
Energy: 0.4559413965115844
Energy: 0.4866284010237741
Energy: 0.4746613611295205
Energy: 0.4642516345027089
Energy: 0.4394471318549548
Energy: 0.47460536520575725
Energy: 0.46122399812243986
Energy: 0.4655236715761297
Energy: 0.47105003956909297
Energy: 0.46161352360088315
Energy: 0.46933840901263174
Energy: 0.47672303829786705
Energy: 0.4618438574432928
Energy: 0.4768676716861423
Energy: 0.7042372171852963
Energy: 0.46208426803578373
Energy: 0.4530173831426943
Energy: 0.44328769275314467
Energy: 0.47619079793650765
Energy: 0.457123555799441
Energy: 0.44824128503210314
Energy: 0.48771435269756436
Energy: 0.4862135659128038
Energy: 0.4445123258814629
Energy: 0.48822544761059183
Energy: 0.4395839912969135
Energy: 0.4717435445443204
Energy: 0.48590157595474537
Energy: 0.4854479961731729
Energy: 0.4480299482716119
Energy: 0.48572128179031504
Energy: 0.43921334127570577
Energy: 0.7908041559236141
Energy: 0.4818799983565865
Energy: 0.4700722087065182
Energy: 0.4685998195538803
Energy: 0.4804447016166994
Energy: 0.4953326083261847
Energy: 0.5244192822664472
Energy: 0.4860801605088191
Energy: 0.4641509870890051
Energy: 0.4478807123106909
Energy: 0.48551091231165666
Energy: 0.4388459620080688
Energy: 0.4708946193227954
Energy: 0.47382764019402196
Energy: 0.47322925901596496
Energy: 0.47088589509879286
Energy: 0.4722294516185499
Energy: 0.48072150758230736
Energy: 0.4719990064913271
Energy: 0.4540348641472594
Energy: 0.4651817526757774
Energy: 0.4725887477183968
Energy: 0.4705728608985586
Energy: 0.46428173613598156
Energy: 0.4716147284573645
Energy: 0.43769544646049136
Energy: 0.448986939120606
Energy: 0.4716564206610236
Energy: 0.4466592195203912
Energy: 0.45476801734059424
Energy: 0.4835047241830079
Energy: 0.44686730477283265
Energy: 0.44693768504395737
Energy: 0.4713388047005487
Energy: 0.44334114697254534
Energy: 0.46413858197721714
Energy: 0.48332357552523614
Energy: 0.4513246849995262
Energy: 0.4552155351503109
Energy: 0.4729618546032664
Energy: 0.4699176984280621
Energy: 0.4488217478201015
Energy: 0.4819090399606397
Energy: 0.46083637392119714
Energy: 0.453746919945573
Energy: 0.4603338052662321
Energy: 0.46006222691945
Energy: 0.4504090372419092
Energy: 0.4832047474397571
Energy: 0.4722530290341463
Energy: 0.4509302391895323
Energy: 0.4667720049708017
Energy: 0.47221169123804974
Energy: 0.44710350600564663
Energy: 0.5123811700931673
Energy: 0.4711181928003528
Energy: 0.48702392259038985
Energy: 0.45836754301172666
Energy: 0.4713082827649846
Energy: 0.43878199500366244
Energy: 0.5103724348530742
Energy: 0.4720186274152091
Energy: 0.47219123958687903
Energy: 0.4582246124908377
Energy: 0.4718391383651889
Energy: 0.4524876536544201
Energy: 0.48288106250897284
Energy: 0.4712031084198334
Energy: 0.4714295076576411
Energy: 0.47668683089846803
Energy: 0.4721456817233958
Energy: 0.46599532886510525
Energy: 0.6052699511779824
Energy: 0.4601383020722547
Energy: 0.48098912198689453
Energy: 0.4808660475660636
Energy: 0.4709813823855283
Energy: 0.48290346695522834
Energy: 0.48270070622408745
Energy: 0.4479892651073201
Energy: 0.43924082930426184
Energy: 0.4858351440822452
Energy: 0.4480421552478875
Energy: 0.4618972101551202
Energy: 0.4669204091100901
Energy: 0.4815085265706354
Energy: 0.48233405590218553
Energy: 0.44748477732849434
Energy: 0.47087980460962
Energy: 0.46383734653386816
Energy: 0.4860269571589247
Energy: 0.43914810736917365
Energy: 0.4322291871774688
Energy: 0.4860257186839387
Energy: 0.4481196042561915
Energy: 0.4848890713869178
Energy: 0.4874601701422597
Energy: 0.45586850160110715
Energy: 0.43897011664083113
Energy: 0.4875505908122396
Energy: 0.4620128601895018
Energy: 0.4905065000669874
Energy: 0.4626282020911085
Energy: 0.46442969765280406
Energy: 0.4390175899998039
Energy: 0.47681674643253175
Energy: 0.4562974321759313
Energy: 0.46576253043962806
Energy: 0.44829423116479966
Energy: 0.4621312890489644
Energy: 0.44762733084208467
Energy: 0.4426279482772687
Energy: 0.4622157464673724
Energy: 0.43954921455188894
Energy: 0.7009392394247314
Energy: 0.4728940834207097
Energy: 0.45751004403013207
Energy: 0.44154386900487297
Energy: 0.4727821641829175
Energy: 0.4690461858540628
Energy: 0.4813454421983129
Energy: 0.48525871527454095
Energy: 0.4852201782796465
Energy: 0.47622885579455115
Energy: 0.4859760479471689
Energy: 0.4736098738560033
Energy: 0.6056888760503386
Energy: 0.4848872547231917
Energy: 0.48599027047227183
Energy: 0.4557141013647628
Energy: 0.48456300240108724
Energy: 0.4576802350344702
Energy: 0.4801482416320866
Energy: 0.47594473891368616
Energy: 0.43857724217961946
Energy: 0.45497084182540704
Energy: 0.47585901312684853
Energy: 0.4497963140931402
Energy: 0.48179182674990206
Energy: 0.4652166352217977
Energy: 0.4408152150783801
Energy: 0.48003984748724526
Energy: 0.46629128718317464
Energy: 0.4514459981919744
Energy: 0.4717339285672393
Energy: 0.4688042533765217
Energy: 0.4556541051852003
Energy: 0.4711340779341058
Energy: 0.46809007263187663
Energy: 0.45709714018308073
Energy: 0.4715694364044405
Energy: 0.4519190400021092
Energy: 0.45185244802779345
Energy: 0.47168202450220326
Energy: 0.4575128599144617
Energy: 0.4641683775560097
Energy: 0.47122278916338906
Energy: 0.5174810298041614
Energy: 0.5176005570816689
Energy: 0.47272076917440126
Energy: 0.47762388506994
Energy: 0.4563435802580185
Energy: 0.48204834661139995
Energy: 0.45182560414529865
Energy: 0.45720539875749866
Energy: 0.4717261677428806
Energy: 0.4585692997272256
Energy: 0.4571037108096768
Energy: 0.481247109450594
Energy: 0.4506854173992586
Energy: 0.45401605170398374
Energy: 0.4628054443044212
Energy: 0.462237019514161
Energy: 0.45639649574698105
Energy: 0.4834607680157644
Energy: 0.46049575039628
Energy: 0.4656665632060518
Energy: 0.47130284700235253
Energy: 0.4606768210703728
Energy: 0.44819876029485956
Energy: 0.515053933842489
Energy: 0.47179700553173415
Energy: 0.47236013980612374
Energy: 0.45811717005985897
Energy: 0.47160553631033636
Energy: 0.42880258390230197

minimum gb energy = 0.42880258390230197 eV
minimum distance =  2.69015839111087 Angstroms
sigma value = 57


========================================
theta = 50.47880364135782
========================================

Energy: 0.2132741423364486
Energy: 0.22005128479635044
Energy: 0.2207648101830675
Energy: 0.2148420961373504
Energy: 0.2446196656273475
Energy: 0.21442761256252355
Energy: 0.21514631278416982
Energy: 0.22717268224578388
Energy: 0.22740447043348952
Energy: 0.24278497973461557
Energy: 0.24408337359245022
Energy: 0.23766582185855678
Energy: 0.27514196024578086
Energy: 0.2452281075739252
Energy: 0.24606755132136848
Energy: 0.2441354461759789
Energy: 0.24516589837738365
Energy: 0.22921875453238158
Energy: 0.27545423450240913
Energy: 0.24559224713733707
Energy: 0.2459474154616356
Energy: 0.2445554966498189
Energy: 0.2747557825865266
Energy: 0.2509155553051488
Energy: 0.27222741721575816
Energy: 0.21463615320393284
Energy: 0.23198669631823038
Energy: 0.27356251172844004
Energy: 0.21409866382506654
Energy: 0.22794353011753088
Energy: 0.24527392227274222
Energy: 0.21418402030159253
Energy: 0.2147153905926252
Energy: 0.22673863057910268
Energy: 0.21390087214514475
Energy: 0.23169587869738045
Energy: 0.2414214522101379
Energy: 0.22704240211332166
Energy: 0.22729067015438756
Energy: 0.24213714067873712
Energy: 0.22807891320342713
Energy: 0.2441135649859715
Energy: 0.2452329113154907
Energy: 0.24551047979427001
Energy: 0.24590369971295498
Energy: 0.2452521808588997
Energy: 0.24550292534518253
Energy: 0.24545284520756358
Energy: 0.27211852177541745
Energy: 0.24539057412973356
Energy: 0.2329036961124534
Energy: 0.24488366916956641
Energy: 0.24402900726096247
Energy: 0.24948001059681155
Energy: 0.21373719196923063
Energy: 0.24521238190249173
Energy: 0.23317772052918034
Energy: 0.2138108493247459
Energy: 0.24397344391826506
Energy: 0.2321307535721727
Energy: 0.21377341689815457
Energy: 0.22690783608023787
Energy: 0.2273589837160681
Energy: 0.2138865134831463
Energy: 0.22635425005002174
Energy: 0.2335359082047792
Energy: 0.27380472988047244
Energy: 0.24509412871515257
Energy: 0.25049612759526574
Energy: 0.2435947612739957
Energy: 0.2442141626343042
Energy: 0.22781061504109576
Energy: 0.2754172184641571
Energy: 0.2755165231904065
Energy: 0.27510758649093114
Energy: 0.2753428530555346
Energy: 0.27523964312648164
Energy: 0.2750465429052617
Energy: 0.2728054198091278
Energy: 0.24490107340210246
Energy: 0.24609946631580243
Energy: 0.27506070009406325
Energy: 0.24390159436377032
Energy: 0.22749597466277569
Energy: 0.27529996162885223
Energy: 0.21409169725831417
Energy: 0.21433434813478908
Energy: 0.24457051693840126
Energy: 0.21668902366075893
Energy: 0.2149108035506692
Energy: 0.24349004121252604
Energy: 0.2504999663946801
Energy: 0.22895096646204294
Energy: 0.24397337080078774
Energy: 0.21428868455365793
Energy: 0.22755982266774064
Energy: 0.24489863012498825
Energy: 0.2503467165187789
Energy: 0.23883574347268777
Energy: 0.24487722115979746
Energy: 0.24449462791583781
Energy: 0.25031571671371
Energy: 0.2746893536149045
Energy: 0.2512715718478201
Energy: 0.25324279739524763
Energy: 0.27481177742862684
Energy: 0.24499688781455833
Energy: 0.2478633452723873
Energy: 0.21390395228872433
Energy: 0.22716417984665496
Energy: 0.22762751514465981
Energy: 0.2139944327114554
Energy: 0.2751726285098443
Energy: 0.24891989249135224

minimum gb energy = 0.2132741423364486 eV
minimum distance =  2.74201225804212 Angstroms
sigma value = 11


========================================
theta = 55.8767054592047
========================================

Energy: 0.7207397932709749
Energy: 0.36729525683311026
Energy: 0.5061691920603959
Energy: 0.39015698418505
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Energy: 0.5063589597885652
Energy: 0.3671361480825342
Energy: 0.3776273350676739
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Energy: 0.35767496200002497
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Energy: 0.36340260007141834
Energy: 0.36656166745026103
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Energy: 0.4093836860267382
Energy: 0.3967532681726419
Energy: 0.3713264142175778
Energy: 0.37755483153091446
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Energy: 0.4210680709460804
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Energy: 0.5420298870457766
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Energy: 0.37673270662391856
Energy: 0.4306888654564637
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Energy: 0.5010511598704805
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Energy: 0.3825423488373726
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Energy: 0.39964964788856394
Energy: 0.39460805752279854
Energy: 0.374221399795536
Energy: 0.39828355607677757
Energy: 0.4348886511140475
Energy: 0.5432210828673357
Energy: 0.3788759909480409
Energy: 0.38336596348741714
Energy: 0.3623382399783904
Energy: 0.3772749291856338
Energy: 0.3695745783564157
Energy: 0.44286279963684194
Energy: 0.43173230808170576
Energy: 0.42504227933162336
Energy: 0.43779817986375014
Energy: 0.5016455626741294
Energy: 0.42579722145327065
Energy: 0.5415913999817401
Energy: 0.4092760602106355
Energy: 0.3976257637864272
Energy: 0.3622787281993834
Energy: 0.43389750645975805
Energy: 0.4023960394523302
Energy: 0.4469766496500488
Energy: 0.5404190296352258
Energy: 0.4549703972357696
Energy: 0.44714022907199275
Energy: 0.5408498327187425
Energy: 0.4233140694225198
Energy: 0.3614559077456971
Energy: 0.3766685012794822
Energy: 0.39810951198668676
Energy: 0.3617573825213079
Energy: 0.3771511400659469
Energy: 0.40349597931293424
Energy: 0.4130322332435305
Energy: 0.38734142092258467
Energy: 0.41216680753445667
Energy: 0.41362758491522356
Energy: 0.44246357541559805
Energy: 0.4125716406444285
Energy: 0.4053168807483829
Energy: 0.3581719628979508
Energy: 0.3595076907033103
Energy: 0.4060724010966604
Energy: 0.36332921200619456
Energy: 0.3572357662027712
Energy: 0.4097298978803909
Energy: 0.3708546193755648
Energy: 0.36211256638382044
Energy: 0.48980801865722795
Energy: 0.3715226926944087
Energy: 0.34819638482500803

minimum gb energy = 0.3478056659241544 eV
minimum distance =  2.70353059098038 Angstroms
sigma value = 41


========================================
theta = 58.99241699313286
========================================

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Energy: 0.4003698219404163
Energy: 0.4003911652447334
Energy: 0.5548106297514432
Energy: 0.4219528719506362
Energy: 0.5547081410913833
Energy: 0.40591086914977936
Energy: 0.38944394257182735
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Energy: 0.3906044477160559
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Energy: 0.40469272388759475
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Energy: 0.45929455841358563
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Energy: 0.4079704999384848
Energy: 0.4591443396247345
Energy: 0.45943416280755545
Energy: 0.4359155511808605
Energy: 0.3891382206037436
Energy: 0.39485432907555745
Energy: 0.3905620315765755
Energy: 0.39522668622619134
Energy: 0.4039099630001235
Energy: 0.4044339156388042
Energy: 0.4695249452913114
Energy: 0.4719024146769509
Energy: 0.40467513804246596
Energy: 0.47030792753921735
Energy: 0.3946033293482845
Energy: 0.43577891298521243
Energy: 0.38921928130518463
Energy: 0.39248815096700573
Energy: 0.4106282861654954
Energy: 0.3953726679300928
Energy: 0.40349901912688446
Energy: 0.5216682108600932
Energy: 0.4170602913481465
Energy: 0.4100665917700687
Energy: 0.4960545503132878
Energy: 0.3947406594459976
Energy: 0.4051020822955661
Energy: 0.5217603895683797
Energy: 0.4152706033668923
Energy: 0.40941431286062746
Energy: 0.4944536100032318
Energy: 0.39562073318871416
Energy: 0.4056626684323659
Energy: 0.43617435821944744
Energy: 0.38809113980156107
Energy: 0.4187567432649666
Energy: 0.4149173282300133
Energy: 0.3944707099566763
Energy: 0.4164552473568498
Energy: 0.39672554773366575
Energy: 0.5615430874745667
Energy: 0.5548714253585479
Energy: 0.3968591684333108
Energy: 0.5519233463136826
Energy: 0.4162168380088327
Energy: 0.447872783299243
Energy: 0.4128553337449286
Energy: 0.40885523612104824
Energy: 0.4479308741880808
Energy: 0.4146970904754171
Energy: 0.41902712789348834
Energy: 0.39428823848931727
Energy: 0.3950984491697139
Energy: 0.3948926403058114
Energy: 0.3943465336585201
Energy: 0.49330041256895746
Energy: 0.3948852014732439
Energy: 0.46431252971643505
Energy: 0.38977464328223554
Energy: 0.4035812643124773
Energy: 0.3967624067110095
Energy: 0.3909318112546758
Energy: 0.3897862387697381
Energy: 0.6381696682114528
Energy: 0.39087745131409046
Energy: 0.40021898434520947
Energy: 0.552659500893101
Energy: 0.389600246647086
Energy: 0.4006659154015068

minimum gb energy = 0.37406123755580056 eV
minimum distance =  2.71706066896043 Angstroms
sigma value = 33


========================================
theta = 62.439396894736774
========================================

Energy: 0.5366243767765518
Energy: 0.4129149719330268
Energy: 0.6640768026819952
Energy: 0.5364595610344992
Energy: 0.45416035170935215
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Energy: 0.42212309693543865
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Energy: 0.4377634707644005
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Energy: 0.4089663762725578
Energy: 0.41944311082197544
Energy: 0.42908271974061013
Energy: 0.4342717329345456
Energy: 0.4407120795467759
Energy: 0.4239305857566193
Energy: 0.42841088928025906
Energy: 0.42396599880666225
Energy: 0.7731883474842504
Energy: 0.42028995484808807
Energy: 0.40715656574632647
Energy: 0.40857818493662634
Energy: 0.5556516209883242
Energy: 0.40730754193148927

minimum gb energy = 0.4058238891018671 eV
minimum distance =  2.71554029246802 Angstroms
sigma value = 67


========================================
theta = 70.52877936550931
========================================

Energy: 0.6357685698459301
Energy: 0.4592267608759876
Energy: 0.45911873821376753
Energy: 0.4598858130934239
Energy: 0.47375224419067063
Energy: 0.45887190295897085
Energy: 0.49092157987513385
Energy: 0.45197651387305465
Energy: 0.4522950791333285
Energy: 0.45101814108673804
Energy: 0.47626182980444637
Energy: 0.45074659681140344
Energy: 0.46258418285744923
Energy: 0.4339012137752912
Energy: 0.4483889767813038
Energy: 0.4489495706523678
Energy: 0.43336156981867496
Energy: 0.4483316883260842
Energy: 0.46242854460776006
Energy: 0.44833318303014785
Energy: 0.449268382886723
Energy: 0.4630375181106849
Energy: 0.44795291252401165
Energy: 0.4492580874275906
Energy: 0.4691925199044779
Energy: 0.45222770656392314
Energy: 0.4524557261887342
Energy: 0.46948904102224
Energy: 0.45216037130954173
Energy: 0.4527650955417318
Energy: 0.469855529056227
Energy: 0.4505383086561483
Energy: 0.4541339428932485
Energy: 0.47012068666008255
Energy: 0.45070752429266936
Energy: 0.4550351818538303
Energy: 0.4908002812167423
Energy: 0.4517580142498335
Energy: 0.45162192209985136
Energy: 0.43047445008386775
Energy: 0.471885234862913
Energy: 0.4515369089070821

minimum gb energy = 0.43047445008386775 eV
minimum distance =  2.74643388166067 Angstroms
sigma value = 3


========================================
theta = 77.88488253796277
========================================

Energy: 0.8091260053113629
Energy: 0.5520967947322492
Energy: 0.5062013675266951
Energy: 0.49034443116149434
Energy: 0.6146615632128817
Energy: 0.5080701529535754
Energy: 0.47988105666071856
Energy: 0.5092947117308388
Energy: 0.4813358097464705
Energy: 0.5013163774413222
Energy: 0.5287911059100364
Energy: 0.4814914215962507
Energy: 0.4918086842518239
Energy: 0.48131863169980604
Energy: 0.48103265859220357
Energy: 0.49210456175348516
Energy: 0.48132597680986866
Energy: 0.4829568140477239
Energy: 0.4823111829657713
Energy: 0.481642886361477
Energy: 0.48176950922435097
Energy: 0.4831447263617933
Energy: 0.48016037701931946
Energy: 0.48160753893560504
Energy: 0.48075342152337475
Energy: 0.4810448686717264
Energy: 0.4811662969704173
Energy: 0.4808949486399013
Energy: 0.49002511027857376
Energy: 0.4816985911699333
Energy: 0.48124356532528
Energy: 0.4810407831024159
Energy: 0.48189999132278843
Energy: 0.4813962781897675
Energy: 0.4906518987599551
Energy: 0.4820866714133602
Energy: 0.48105440973023006
Energy: 0.5180624206375889
Energy: 0.5076323543390371
Energy: 0.5050746823654677
Energy: 0.51662829889085
Energy: 0.5051767709486572
Energy: 0.7613899674390973
Energy: 0.5308402156966971
Energy: 0.5005635704527605
Energy: 0.48188157398522663
Energy: 0.5303818491205702
Energy: 0.4946161211580455
Energy: 0.48277483316695535
Energy: 0.4816312111611375
Energy: 0.4875602340105004
Energy: 0.4982534899418472
Energy: 0.4888716575419097
Energy: 0.4935241245919923
Energy: 0.5600318257995749
Energy: 0.4804653594876494
Energy: 0.4804924767055669
Energy: 0.5403997375756189
Energy: 0.48062047143024517
Energy: 0.5018923434391996
Energy: 0.5259618550926838
Energy: 0.48550283950477346
Energy: 0.5037516564876093
Energy: 0.5265279231561506
Energy: 0.4886970756702988
Energy: 0.5065523975713732
Energy: 0.4940176669193166
Energy: 0.4820787093239592
Energy: 0.48193055438558036
Energy: 0.5075487579676881
Energy: 0.49338725443015563
Energy: 0.48189278365547433
Energy: 0.5029105982102618
Energy: 0.4817511755810753
Energy: 0.4823330019916923
Energy: 0.5135663192847879
Energy: 0.48130426743796967
Energy: 0.482039787389682
Energy: 0.5059166586155922
Energy: 0.481164671215802
Energy: 0.4812748327598786
Energy: 0.4881522553376062
Energy: 0.48177842335081084
Energy: 0.4811609190272022
Energy: 0.526258573300127
Energy: 0.4908899856067168
Energy: 0.49119267858413795
Energy: 0.48858602058442624
Energy: 0.49084459360220656
Energy: 0.48640991691540947
Energy: 0.4990963664068998
Energy: 0.48097954127039677
Energy: 0.4810792483812972
Energy: 0.488902811276121
Energy: 0.4986205713594983
Energy: 0.48110923107247955
Energy: 0.5845344017296715
Energy: 0.493657470568485
Energy: 0.49335810238777145
Energy: 0.572664519816426
Energy: 0.5028471558501066
Energy: 0.5177440917247461
Energy: 0.5016052226832366
Energy: 0.5189500263808196
Energy: 0.4983855003141693
Energy: 0.5077215932961097
Energy: 0.49677627975068467
Energy: 0.4987660025255429
Energy: 0.5498667782084199
Energy: 0.48284884250044796
Energy: 0.4823303594305728
Energy: 0.48083658745240615
Energy: 0.49814713424582596
Energy: 0.4802637607662166
Energy: 0.5473709332597256
Energy: 0.4940048069475259
Energy: 0.4999219075251252
Energy: 0.48535469070666254
Energy: 0.4943484473140524
Energy: 0.48055520040081107
Energy: 0.4929199595891906
Energy: 0.498336790753413
Energy: 0.5003339240487705
Energy: 0.4997871922808211
Energy: 0.49289461958060143
Energy: 0.49628575889602883
Energy: 0.49359604731629436
Energy: 0.5389735355252083
Energy: 0.4945481259171752
Energy: 0.49942202028620153
Energy: 0.4961050590395111
Energy: 0.4947759335520782
Energy: 0.4980496122458144
Energy: 0.49700009294482467
Energy: 0.4983300781375468
Energy: 0.4983793976848595
Energy: 0.4993412684887279
Energy: 0.5011766352123145
Energy: 0.4958393501658269
Energy: 0.48614326005970926
Energy: 0.48542599491267396
Energy: 0.4960160555867539
Energy: 0.4867393074671537
Energy: 0.49563758935860225
Energy: 0.4838667647516479
Energy: 0.5005467908850699
Energy: 0.4813862234637904
Energy: 0.5043899497910513
Energy: 0.49237771941539504
Energy: 0.48099270497907504
Energy: 0.6937282764168486
Energy: 0.5146871174789028
Energy: 0.5036634614761968
Energy: 0.4992500682447965
Energy: 0.526390296932992
Energy: 0.5153273794254403
Energy: 0.4806695708037381
Energy: 0.5169545982049953
Energy: 0.510752568138548
Energy: 0.4853722774934293
Energy: 0.5262968989487665
Energy: 0.5020866332500096
Energy: 0.4851324325254613
Energy: 0.4813038186391703
Energy: 0.481052377349712
Energy: 0.4981564910111087
Energy: 0.49601544918593843
Energy: 0.48133842692170403
Energy: 0.48537936586202224
Energy: 0.48176270318897424
Energy: 0.48159658698805907
Energy: 0.48551881382384304
Energy: 0.4822175418624304
Energy: 0.48686995613030504
Energy: 0.48222656518120943
Energy: 0.4824963289993207
Energy: 0.48050946377318077
Energy: 0.4830959863020279
Energy: 0.504729476621944
Energy: 0.4812201159572044
Energy: 0.4814381672734691
Energy: 0.4834983546806174
Energy: 0.4829678542591272
Energy: 0.4815587342952916
Energy: 0.48422921752965475
Energy: 0.4827236054911196
Energy: 0.48667211386433196
Energy: 0.5081042361381133
Energy: 0.48871379612387067
Energy: 0.498431508033685
Energy: 0.5126997933853605
Energy: 0.4808906430568901
Energy: 0.6233959161520359
Energy: 0.5177263941276533
Energy: 0.5162418780938203
Energy: 0.4809861653877179
Energy: 0.5310638357241461
Energy: 0.49960157455519333
Energy: 0.5155844782451355
Energy: 0.48251927592399635
Energy: 0.48257750386605947
Energy: 0.4954902587481418
Energy: 0.5182586288969552
Energy: 0.49627886024396756
Energy: 0.48069714250169193
Energy: 0.5029715364002587
Energy: 0.4802821149741564
Energy: 0.48935792484934065
Energy: 0.4866150470258048
Energy: 0.48140320233579265
Energy: 0.528799964222983
Energy: 0.48044751405396635
Energy: 0.48041684920507394
Energy: 0.5285942203400679
Energy: 0.480705398503895
Energy: 0.5018764532166013
Energy: 0.49476287665910773
Energy: 0.4811084452115541
Energy: 0.4812766840876753
Energy: 0.4957073621364908
Energy: 0.48775742038439746
Energy: 0.49067203162079526
Energy: 0.5036331056948191
Energy: 0.4827845949525867
Energy: 0.4838003253453686
Energy: 0.48497258175557517
Energy: 0.48248263159193283
Energy: 0.509782046726536
Energy: 0.49499443867785003
Energy: 0.48168841937587137
Energy: 0.48203769164500126
Energy: 0.49966725696162045
Energy: 0.48340211660089916
Energy: 0.48121958133562837
Energy: 0.5255397967649071
Energy: 0.48319730489571655
Energy: 0.48361021324914355
Energy: 0.4888169660594021
Energy: 0.4832125219939735
Energy: 0.48534418886318564
Energy: 0.5277999083992061
Energy: 0.4820642331546182
Energy: 0.481847929449943
Energy: 0.4828311626041134
Energy: 0.4835122435020395
Energy: 0.4815823957326167
Energy: 0.5714074736510615
Energy: 0.4889752567899535
Energy: 0.5061143310965998
Energy: 0.5722103438874173
Energy: 0.4815977479978328
Energy: 0.4963841081730473
Energy: 0.5635357921677003
Energy: 0.5020147133948103
Energy: 0.4925676578962
Energy: 0.5585910988154477
Energy: 0.4827052675964271
Energy: 0.5172962695385221
Energy: 0.5190621475854629
Energy: 0.4815269186508112
Energy: 0.481060359083362
Energy: 0.48829998381693596
Energy: 0.4818812470506573
Energy: 0.48127562760997583
Energy: 0.7151176111446328
Energy: 0.49536081265326637
Energy: 0.48805831538706457
Energy: 0.5019911004471926
Energy: 0.49659357415117006
Energy: 0.48791790206753705
Energy: 0.4992077297867786
Energy: 0.5025015021216651
Energy: 0.5024884353846066
Energy: 0.49938776044402977
Energy: 0.49784901207907484
Energy: 0.5050378974674511
Energy: 0.49315205653246535
Energy: 0.4947990904719806
Energy: 0.4943323945978391
Energy: 0.501185376027561
Energy: 0.49928985450553404
Energy: 0.4948123808284344
Energy: 0.4931206768663491
Energy: 0.49743941803923714
Energy: 0.4972445619812478
Energy: 0.49347772949052504
Energy: 0.4998111152638014
Energy: 0.49738268720384887
Energy: 0.49323976586616225
Energy: 0.48100222539802723
Energy: 0.48251311084689436
Energy: 0.4940514782071574
Energy: 0.4814796240462742
Energy: 0.5008352081297185
Energy: 0.4855960954109598
Energy: 0.48108593278884754
Energy: 0.48101497943572114
Energy: 0.4985795499759358
Energy: 0.4811343986119022
Energy: 0.4827072102646131
Energy: 0.4796325802235691
Energy: 0.4814736735039663
Energy: 0.49636145943119575
Energy: 0.516869460613501
Energy: 0.4873929567963796
Energy: 0.4827385881200502

minimum gb energy = 0.4796325802235691 eV
minimum distance =  2.72161609934872 Angstroms
sigma value = 81


========================================
theta = 80.63108442154517
========================================

Energy: 0.9292055783558646
Energy: 0.5187161106384486
Energy: 0.5189934033195583
Energy: 0.5677330253195664
Energy: 0.6052006816376162
Energy: 0.5189793711643169
Energy: 0.4709126724613673
Energy: 0.5003346104346238
Energy: 0.5126322505985552
Energy: 0.4976188643112715
Energy: 0.5224156842648896
Energy: 0.5123590219450411
Energy: 0.4928243787062262
Energy: 0.4902392913978813
Energy: 0.48701994579922414
Energy: 0.493398901858534
Energy: 0.4905345015783254
Energy: 0.5089777630465291
Energy: 0.4939077143648539
Energy: 0.4881515037726051
Energy: 0.5097593371509225
Energy: 0.49384339105091873
Energy: 0.49063298521014775
Energy: 0.49365340480853787
Energy: 0.4948312430490798
Energy: 0.5091244033027859
Energy: 0.5166933333756902
Energy: 0.49491832591588975
Energy: 0.5129214042832588
Energy: 0.49264060167416895
Energy: 0.5015483114561218
Energy: 0.4918072375122251
Energy: 0.5106958218352626
Energy: 0.5013977591791887
Energy: 0.49193088415242037
Energy: 0.47257012711121216
Energy: 0.486352302610886
Energy: 0.4711199363696721
Energy: 0.48995334157297105
Energy: 0.47139443741259845
Energy: 0.4743438583614733
Energy: 0.49135093300738747
Energy: 0.5782008672782857
Energy: 0.5374383298610313
Energy: 0.5286375263370877
Energy: 0.4704603046615034
Energy: 0.5376476320778324
Energy: 0.4804169259541081
Energy: 0.5772584688584251
Energy: 0.47139620524233256
Energy: 0.49121934688745744
Energy: 0.5299261864833705
Energy: 0.49499480899887294
Energy: 0.49089324848040594
Energy: 0.5804338104947679
Energy: 0.507300175163411
Energy: 0.5100609843502905
Energy: 0.5338325575926731
Energy: 0.491758575790786
Energy: 0.504611586161961
Energy: 0.5532016783266381
Energy: 0.4906853449521437
Energy: 0.49091954420655726
Energy: 0.530963342164689
Energy: 0.471757175774622
Energy: 0.508667153181926
Energy: 0.4786038261364709
Energy: 0.471245717664723
Energy: 0.4712361302996026
Energy: 0.4705549319596196
Energy: 0.471270011126593
Energy: 0.47120229915291695
Energy: 0.5073772699623582
Energy: 0.5035221470180697
Energy: 0.48918680583419877
Energy: 0.49073367658514994
Energy: 0.5090814348538555
Energy: 0.48701897651624304
Energy: 0.4830039475776372
Energy: 0.47152830900131065
Energy: 0.47203870511318047
Energy: 0.49828573038976914
Energy: 0.4724489213902803
Energy: 0.4715452669724017
Energy: 0.5086915861338038
Energy: 0.505925897918615
Energy: 0.5071301016096043
Energy: 0.49692034281029995
Energy: 0.4727815517459917
Energy: 0.5176584722977847
Energy: 0.49841996361032703
Energy: 0.5101238785754737
Energy: 0.510270760477829
Energy: 0.4802357071512344
Energy: 0.4771394909905894
Energy: 0.49694957974898823
Energy: 0.5857769395135171
Energy: 0.47020205113138364
Energy: 0.46991217023927756
Energy: 0.5859828810678145
Energy: 0.47038921272819145
Energy: 0.4780803683006043
Energy: 0.4776256827837073
Energy: 0.5082936960054596
Energy: 0.49594345244422516
Energy: 0.4779240112252024
Energy: 0.5302410456791644
Energy: 0.4974964091913093
Energy: 0.4767246587299212
Energy: 0.5301766194719016
Energy: 0.530224827355074
Energy: 0.49845118969380775
Energy: 0.5310398749438735
Energy: 0.5104493395408364
Energy: 0.4767615049764918
Energy: 0.5301214598216527
Energy: 0.5099533485784608
Energy: 0.49828921286911804
Energy: 0.5313122935672948
Energy: 0.5102621947534531
Energy: 0.4771549111145422
Energy: 0.5096971580275763
Energy: 0.5048217788796411
Energy: 0.47737947597878444
Energy: 0.5303988140870219
Energy: 0.47698611394415624
Energy: 0.5104914383958933
Energy: 0.4683291943500416
Energy: 0.46939915371295143
Energy: 0.5105439513353789
Energy: 0.48960202504886313
Energy: 0.469251425217837
Energy: 0.5076110409488797
Energy: 0.5075825539194295
Energy: 0.4772668886525934
Energy: 0.47829561927181197
Energy: 0.47708121355871375
Energy: 0.4774843141693354
Energy: 0.5106938856501049
Energy: 0.5141211442820575
Energy: 0.4786244357999994
Energy: 0.4784845580465397
Energy: 0.5009545762181409
Energy: 0.4783835819403814
Energy: 0.4809103643033104
Energy: 0.49044672146172485
Energy: 0.49022369808718597
Energy: 0.4985679833490136
Energy: 0.47173808314499127
Energy: 0.5014278477122937
Energy: 0.7132291365926997
Energy: 0.5294765869961147
Energy: 0.5301498529619362
Energy: 0.4701473152284422
Energy: 0.6002121024914696
Energy: 0.5291927948928135
Energy: 0.5785986707467617
Energy: 0.5294953013087552
Energy: 0.4902320321106921
Energy: 0.4705400723659841
Energy: 0.5334962866215139
Energy: 0.49026257917927835
Energy: 0.5542223890419828
Energy: 0.49009422970356326
Energy: 0.49096721231626556
Energy: 0.5315176291450777
Energy: 0.4713873749617337
Energy: 0.5106418947228415
Energy: 0.5474915158876692
Energy: 0.5075441498912401
Energy: 0.5020735779284884
Energy: 0.530275012555287
Energy: 0.5001721869791479
Energy: 0.5025323863943495
Energy: 0.5476305426511571
Energy: 0.4713148513768861
Energy: 0.49029935103984923
Energy: 0.5297136699404887
Energy: 0.49530040999667707
Energy: 0.5087280177433908
Energy: 0.4783598966972851
Energy: 0.4709568141660447
Energy: 0.4921521859239925
Energy: 0.4908583399976281
Energy: 0.47176861721984903
Energy: 0.4869088015805394
Energy: 0.4909420122232764
Energy: 0.47161474242038465
Energy: 0.47169670173334716
Energy: 0.47134506527471115
Energy: 0.4966503550899247
Energy: 0.4713376819972189
Energy: 0.49731675107523143
Energy: 0.47280065182096465
Energy: 0.5016216246967391
Energy: 0.5140737762325182
Energy: 0.47300868389412837
Energy: 0.5079896798846218
Energy: 0.4994577505938262
Energy: 0.4963093216015714
Energy: 0.4956952101974607
Energy: 0.4931393990644134
Energy: 0.5020045007220009
Energy: 0.5144557216988781
Energy: 0.5003639642650735
Energy: 0.5141162381573069
Energy: 0.5145584793028555
Energy: 0.499708161147233
Energy: 0.470351556774088
Energy: 0.5145666084349009
Energy: 0.5627316736389565
Energy: 0.4700710870446125
Energy: 0.4703344951768735
Energy: 0.5626217383884217
Energy: 0.4699880748683703
Energy: 0.5432028131842017
Energy: 0.5049812097565518
Energy: 0.5027067277127083
Energy: 0.5123952417627203
Energy: 0.49734301524259455
Energy: 0.522088735569239
Energy: 0.51203067699266
Energy: 0.4709303822353049
Energy: 0.5902096876404807
Energy: 0.5196451459809761
Energy: 0.5075931318287387
Energy: 0.5901490867108078
Energy: 0.5057606495284814

minimum gb energy = 0.4683291943500416 eV
minimum distance =  2.67411877042032 Angstroms
sigma value = 43


========================================
theta = 82.945868617881
========================================

Energy: 0.8688564886255917
Energy: 0.5788296301611131
Energy: 0.5290710115130043
Energy: 0.4898281812336786
Energy: 0.6090365127964206
Energy: 0.49010284190211467
Energy: 0.47286589349767283
Energy: 0.4843669689033907
Energy: 0.5030166044060923
Energy: 0.4796054218183053
Energy: 0.4787353800746822
Energy: 0.4805030158968619
Energy: 0.47943322722068016
Energy: 0.47247893832055565
Energy: 0.4724632232346819
Energy: 0.5390909663962429
Energy: 0.4727836730487207
Energy: 0.48060884503377965
Energy: 0.48158171948041967
Energy: 0.4728631287158955
Energy: 0.4809946179560529
Energy: 0.48139820178776405
Energy: 0.4872838505331683
Energy: 0.48095233256320125
Energy: 0.4812291769036301
Energy: 0.48506345698485653
Energy: 0.49700303537109597
Energy: 0.48010193152454694
Energy: 0.49402196914663005
Energy: 0.4969107139349694
Energy: 0.48144193378824374
Energy: 0.4952963854787817
Energy: 0.4969413453487246
Energy: 0.4840868571364843
Energy: 0.47991542472301996
Energy: 0.498177815596945
Energy: 0.47990230969073505
Energy: 0.4819637034067162
Energy: 0.4820643983525886
Energy: 0.47908338061609657
Energy: 0.481915383160681
Energy: 0.48093347766461886
Energy: 0.5195011920393475
Energy: 0.4791027183853224
Energy: 0.47935148667845223
Energy: 0.47596246408110476
Energy: 0.47896565076127645
Energy: 0.47972620987237435
Energy: 0.4839016169259227
Energy: 0.4819010349482685
Energy: 0.48186517134010887
Energy: 0.4836999594308414
Energy: 0.47927833271038556
Energy: 0.48195984951338106
Energy: 0.583780976761398
Energy: 0.4820798045935599
Energy: 0.5175453220368351
Energy: 0.5842014472891284
Energy: 0.4823826378940567
Energy: 0.5184460597167299
Energy: 0.4753987071481989
Energy: 0.47425390052332983
Energy: 0.4992303192834299
Energy: 0.48385346667340645
Energy: 0.48293948324323893
Energy: 0.4801025211002933
Energy: 0.494173992256187
Energy: 0.4814570103464784
Energy: 0.4813146158553096
Energy: 0.4816156911144465
Energy: 0.4815917647268275
Energy: 0.4812971942388165
Energy: 0.49178231649510107
Energy: 0.4804174864990808
Energy: 0.48817360952845806
Energy: 0.47348392594148864
Energy: 0.5037529983235466
Energy: 0.48815728735061487
Energy: 0.47553755781369134
Energy: 0.48212095364408103
Energy: 0.5076270417520615
Energy: 0.48390791294256175
Energy: 0.4817207481124016
Energy: 0.4813885579411746
Energy: 0.4758992608525251
Energy: 0.5183402769925901
Energy: 0.4862299226596523
Energy: 0.47583892315036075
Energy: 0.4819241298127462
Energy: 0.4787796216536434
Energy: 0.4765366874946699
Energy: 0.4801287997219123
Energy: 0.47634541196245994
Energy: 0.47510509085706043
Energy: 0.4856530065135442
Energy: 0.47541455440975183
Energy: 0.4780363281530707
Energy: 0.4778824081771358
Energy: 0.4774087645492265
Energy: 0.47807683402591583
Energy: 0.4798590879712272
Energy: 0.47784423784200464
Energy: 0.47725647694451917
Energy: 0.49119249506891394
Energy: 0.47566601925351915
Energy: 0.5199946095025422
Energy: 0.47573365408415935
Energy: 0.4758372200466291
Energy: 0.48333997409581525
Energy: 0.47641138442705405
Energy: 0.4765320217055035
Energy: 0.4828198982795133
Energy: 0.4762777869063913
Energy: 0.48123064803356136
Energy: 0.4829391865865178
Energy: 0.47682898823204023
Energy: 0.47668938242792247
Energy: 0.537163826587023
Energy: 0.4765166039015835
Energy: 0.48112245757392896
Energy: 0.4767795438555559
Energy: 0.4757470516184119
Energy: 0.5004998693604801
Energy: 0.48996688971780805
Energy: 0.48802422416565094
Energy: 0.47576236390314386
Energy: 0.5383526239003535
Energy: 0.4889303415681375
Energy: 0.48880059418583993
Energy: 0.5382245862529637
Energy: 0.4745905799460801
Energy: 0.4886569285445023
Energy: 0.5321821226886024
Energy: 0.4755334864070967
Energy: 0.47601093932483035
Energy: 0.49050441830592134
Energy: 0.4759649954518466
Energy: 0.47580402453510573
Energy: 0.5407548728575123
Energy: 0.47775486608251244
Energy: 0.47735748292268854
Energy: 0.47544630764868107
Energy: 0.48121005408633655
Energy: 0.47701331756063164
Energy: 0.5191498600028575
Energy: 0.475973234848434
Energy: 0.4760100075460337
Energy: 0.49072061743374235
Energy: 0.47562398852880416
Energy: 0.4762669613910967
Energy: 0.5202316582080898
Energy: 0.47564905918506767
Energy: 0.4800821841740045
Energy: 0.4809708677008609
Energy: 0.47541967369540916
Energy: 0.48775191786999006
Energy: 0.5191234521912362
Energy: 0.4751676274297058
Energy: 0.4799221078175213
Energy: 0.4817665849554028
Energy: 0.48380031825273245
Energy: 0.4803144177969016
Energy: 0.5256316335151462
Energy: 0.47924209896903575
Energy: 0.48098181265474904
Energy: 0.4812419821554056
Energy: 0.4880493611694222
Energy: 0.4814356759106667
Energy: 0.4988789287163164
Energy: 0.48065690158185215
Energy: 0.4808024854406013
Energy: 0.4988595538957955
Energy: 0.475375748353265
Energy: 0.4808014563232264
Energy: 0.48187014550168367
Energy: 0.48434575726720813
Energy: 0.503144049279398
Energy: 0.5191178945757763
Energy: 0.4844187730077187
Energy: 0.48195707633969703
Energy: 0.4739300758764186
Energy: 0.5398994570097903
Energy: 0.5468051723457403
Energy: 0.4896706300221219
Energy: 0.561855182929444
Energy: 0.5416547830632452

minimum gb energy = 0.4724632232346819 eV
minimum distance =  2.65981299859881 Angstroms
sigma value = 57


========================================
theta = 86.6277133165661
========================================

Energy: 0.597661517548228
Energy: 0.4959034770398161
Energy: 0.49597474515597906
Energy: 0.4732241430249638
Energy: 0.5270641392816177
Energy: 0.49627161373259926
Energy: 0.4504799270596303
Energy: 0.4816344999967814
Energy: 0.4799507097870457
Energy: 0.48657645614699635
Energy: 0.4874885984226561
Energy: 0.4904029177625156
Energy: 0.47783762865581736
Energy: 0.44812980298848043
Energy: 0.447957436463446
Energy: 0.47866801924063374
Energy: 0.4481774614928974
Energy: 0.44822202037665393
Energy: 0.4786597305827196
Energy: 0.44774944994268645
Energy: 0.4481322352600622
Energy: 0.47918902325332724
Energy: 0.46244720801527883
Energy: 0.4789128829174738
Energy: 0.47906131252803447
Energy: 0.47665107700886283
Energy: 0.4759451260064363
Energy: 0.4792579372146887
Energy: 0.46852800316241483
Energy: 0.4766230244575655
Energy: 0.4629318739768829
Energy: 0.46901669945949787
Energy: 0.468374194219639
Energy: 0.48299604818350966
Energy: 0.4737736547750488
Energy: 0.4685011955367335
Energy: 0.4874876638384666
Energy: 0.4786178132412594
Energy: 0.4787020856695986
Energy: 0.486792283519389
Energy: 0.4783838692954517
Energy: 0.4811674526290677
Energy: 0.49511568694730473
Energy: 0.4738647577908652
Energy: 0.471881450806544
Energy: 0.47470205216165956
Energy: 0.48325413270309
Energy: 0.48418307686221523
Energy: 0.4860232290699469
Energy: 0.4802509124234356
Energy: 0.49011748209692774
Energy: 0.4862005807105354
Energy: 0.48100312326327
Energy: 0.48418826997652953
Energy: 0.4830179081891252
Energy: 0.47649649233759467
Energy: 0.4765707510555091
Energy: 0.4833781820099966
Energy: 0.47649101186347587
Energy: 0.4763958738232613
Energy: 0.4750553184625301
Energy: 0.4751914199884456
Energy: 0.48983920527288205
Energy: 0.4881960698010895
Energy: 0.4784292103281237
Energy: 0.4791102468467122
Energy: 0.44778276678694273
Energy: 0.47979530804995557
Energy: 0.47879546472878726
Energy: 0.44934507155421044
Energy: 0.4854654746480124
Energy: 0.5011942431483003
Energy: 0.44767088587835957
Energy: 0.48181255856463767
Energy: 0.5014741715629113
Energy: 0.46131407222748055
Energy: 0.4843739049183656
Energy: 0.5015512124066636
Energy: 0.47327875458239865
Energy: 0.4953471144291301
Energy: 0.4896542775977654
Energy: 0.48683183978500794
Energy: 0.4865635227834895
Energy: 0.47904579504890343
Energy: 0.4763948638014677
Energy: 0.45165888534540605
Energy: 0.4493661129603175
Energy: 0.47491075594937665
Energy: 0.4524987057161627
Energy: 0.4714739200401946
Energy: 0.47959785449053255
Energy: 0.47584543397803336
Energy: 0.4818382658553438
Energy: 0.478184834722282
Energy: 0.47559033484648333
Energy: 0.4769347224735415
Energy: 0.493161211645585
Energy: 0.47560441581189344
Energy: 0.4842181343624762
Energy: 0.4774230795885007
Energy: 0.47569527296755004
Energy: 0.4786208813755689
Energy: 0.49320844535825
Energy: 0.4788996501435422
Energy: 0.4684583608512665
Energy: 0.4745100474757391
Energy: 0.4793208614307107
Energy: 0.47646750476612854
Energy: 0.4875604045713052
Energy: 0.47906777304123804
Energy: 0.4794127211181488
Energy: 0.47578331103251476
Energy: 0.4794475991126549
Energy: 0.4883161550458048
Energy: 0.48725520620721097
Energy: 0.47939392077381676
Energy: 0.4875421381270452
Energy: 0.49710409004696493
Energy: 0.4799283823504832
Energy: 0.4881067920866197
Energy: 0.48680638350466937
Energy: 0.4972724836337634
Energy: 0.49766197447795985
Energy: 0.4872562446666297
Energy: 0.4973177705178759
Energy: 0.4770516373642681
Energy: 0.5202464033697654
Energy: 0.4791501828704527
Energy: 0.47978819923344107
Energy: 0.5199850812239765
Energy: 0.4783762580187448
Energy: 0.46877458541791517
Energy: 0.47092592471956074
Energy: 0.49534849302551465
Energy: 0.49679701671775245
Energy: 0.4870376134552271
Energy: 0.4870626544811046
Energy: 0.49428991715569565
Energy: 0.4477379258706457
Energy: 0.4821243362211279
Energy: 0.5014599838377073
Energy: 0.4614157649947265
Energy: 0.48419336178480576
Energy: 0.5015421872171514

minimum gb energy = 0.44767088587835957 eV
minimum distance =  2.68807633727968 Angstroms
sigma value = 17


========================================
theta = 93.3722866834339
========================================

Energy: 0.43456357354157304
Energy: 0.529998081564378
Energy: 0.5294965373583373
Energy: 0.45823569690528165
Energy: 0.4968581235813796
Energy: 0.4978043627810333
Energy: 0.45758833689295286
Energy: 0.5136432435870902
Energy: 0.5138284026716663
Energy: 0.5325510611461641
Energy: 0.514306144784071
Energy: 0.48320043807888985
Energy: 0.630853265741099
Energy: 0.4666942458534217
Energy: 0.4582686821935113
Energy: 0.5142607119961004
Energy: 0.4589249099138408
Energy: 0.4583240078061983
Energy: 0.5160659548245163
Energy: 0.45829185126382305
Energy: 0.45808497394222264
Energy: 0.513498641239317
Energy: 0.4506189368160998
Energy: 0.513702518255131
Energy: 0.4516469768979106
Energy: 0.4588790895307653
Energy: 0.45790097109816863
Energy: 0.4511079249652057
Energy: 0.4587545638362619
Energy: 0.4605845994046734
Energy: 0.45886898021439676
Energy: 0.4445987957386373
Energy: 0.4585694890386833
Energy: 0.44522223740313843
Energy: 0.44999061942827623
Energy: 0.4467461435412197
Energy: 0.44449134631668397
Energy: 0.44371113091102526
Energy: 0.44398124657531524
Energy: 0.4447293460017068
Energy: 0.44372125664429296
Energy: 0.44678760525831707
Energy: 0.4446792924864096
Energy: 0.44971755878534264
Energy: 0.4502512165977373
Energy: 0.4501169923658889
Energy: 0.4491376815147447
Energy: 0.44631151509407097
Energy: 0.44599739858507836
Energy: 0.4489563719202673
Energy: 0.448391032612127
Energy: 0.4438174803826083
Energy: 0.4604491185220855
Energy: 0.44460509677492716
Energy: 0.4444647432008734
Energy: 0.46261088589380644
Energy: 0.45996908548515375
Energy: 0.44460828259203594
Energy: 0.4609733374299716
Energy: 0.4601465861908921
Energy: 0.5256587288726673
Energy: 0.45834107123952134
Energy: 0.45816688687532653
Energy: 0.4587394978138269
Energy: 0.4511244550365999
Energy: 0.4581379781374882
Energy: 0.5126432790222266
Energy: 0.5132273599664053
Energy: 0.5132934330477712
Energy: 0.5121540661536187
Energy: 0.5137133288444314
Energy: 0.513479849526896
Energy: 0.4508708049669432
Energy: 0.5145657111816891
Energy: 0.5141114440547426
Energy: 0.4586432464186182
Energy: 0.5142740729289179
Energy: 0.5186322086197509
Energy: 0.518462522660437
Energy: 0.5139108491839319
Energy: 0.5141185162608751
Energy: 0.5147579507692218
Energy: 0.5140423392815691
Energy: 0.4796644768050638
Energy: 0.5006937454190219
Energy: 0.5112941526813516
Energy: 0.5112714642255102
Energy: 0.4962654910730346
Energy: 0.5024676486331362
Energy: 0.5169745990904742
Energy: 0.4987271353043493
Energy: 0.5271128178502629
Energy: 0.48026102816008903
Energy: 0.5143188625862717
Energy: 0.527160992223947
Energy: 0.5135043868332897
Energy: 0.5055474612933936
Energy: 0.5142056287012104
Energy: 0.5674582870975127
Energy: 0.4653831139831719
Energy: 0.5141273373129965
Energy: 0.5674047681831393

minimum gb energy = 0.43456357354157304 eV
minimum distance =  2.69402729047267 Angstroms
sigma value = 17


========================================
theta = 97.054131382119
========================================

Energy: 0.810547748833316
Energy: 0.575094587132208
Energy: 0.4820296031193601
Energy: 0.45463852142927663
Energy: 0.6415528864758968
Energy: 0.47446183416724586
Energy: 0.45896709891270493
Energy: 0.5099265833349351
Energy: 0.43704461123117255
Energy: 0.509632141331311
Energy: 0.5115869165581615
Energy: 0.46771657583270326
Energy: 0.6077144199837192
Energy: 0.4220847096900979
Energy: 0.45558830749935497
Energy: 0.5136071876086352
Energy: 0.42196130672875143
Energy: 0.4596207466286566
Energy: 0.5119340144585173
Energy: 0.45735952218838555
Energy: 0.4579800943173599
Energy: 0.5130052808315698
Energy: 0.41624768143147156
Energy: 0.4586968181720663
Energy: 0.44337669343788755
Energy: 0.43718030888705006
Energy: 0.4411055038057444
Energy: 0.4440050505467078
Energy: 0.43815920577646267
Energy: 0.4334739746728334
Energy: 0.45788952324896154
Energy: 0.4363755411869963
Energy: 0.4197465836486911
Energy: 0.4194877225615248
Energy: 0.4363823348542102
Energy: 0.41969811961648135
Energy: 0.40539840801743565
Energy: 0.4361879177952094
Energy: 0.43618604938815553
Energy: 0.41768247892344695
Energy: 0.43855917566594577
Energy: 0.42545664945011974
Energy: 0.40600832257943953
Energy: 0.40844459799354615
Energy: 0.41334460243972976
Energy: 0.42020187607681825
Energy: 0.4087119092680793
Energy: 0.413193414397955
Energy: 0.40609465051127236
Energy: 0.4149875246100125
Energy: 0.4061640633001928
Energy: 0.4069845541706012
Energy: 0.4126876919460314
Energy: 0.4058309928139955
Energy: 0.40559265606709966
Energy: 0.41361157891076883
Energy: 0.4136474657730906
Energy: 0.4057392087954453
Energy: 0.41322752068810126
Energy: 0.4135200047099766
Energy: 0.4158625481230777
Energy: 0.40578080251624504
Energy: 0.41259622875405555
Energy: 0.41232830647869884
Energy: 0.4059043808851731
Energy: 0.41274714348789016
Energy: 0.4075735756419119
Energy: 0.4062889609101955
Energy: 0.40593737867668683
Energy: 0.40793503960137434
Energy: 0.40898788473704367
Energy: 0.4156755172663974
Energy: 0.4150493066334785
Energy: 0.4170786644612057
Energy: 0.4134795049194179
Energy: 0.41432120642505565
Energy: 0.41720486608588253
Energy: 0.41343528898388404
Energy: 0.435952716512922
Energy: 0.4199287653837009
Energy: 0.41605411932333264
Energy: 0.4368324712426046
Energy: 0.42484997129541746
Energy: 0.4362248756200792
Energy: 0.4360993325592183
Energy: 0.4200210346327714
Energy: 0.4268160207474259
Energy: 0.43617122321055124
Energy: 0.4235561008715837
Energy: 0.4401005077470078
Energy: 0.5087074243001867
Energy: 0.4483005877257715
Energy: 0.44314407912126796
Energy: 0.44430230130965
Energy: 0.4440123433162813
Energy: 0.44339817438018764
Energy: 0.40612366226399005
Energy: 0.5102820524455367
Energy: 0.509969961660765
Energy: 0.40722772945287317
Energy: 0.5099290590636546
Energy: 0.43578858792741115
Energy: 0.4068063837023902
Energy: 0.509874646927872
Energy: 0.5079440117364817
Energy: 0.4446444595353929
Energy: 0.513217518477929
Energy: 0.4434642734512148
Energy: 0.5673081666356864
Energy: 0.5100122194516695
Energy: 0.4773990045114999
Energy: 0.5107131838308034
Energy: 0.4529185845256347
Energy: 0.4433631864881791
Energy: 0.6663192354022188
Energy: 0.4398863348508339
Energy: 0.43990742720928366
Energy: 0.6160362603263028
Energy: 0.44935278595617184
Energy: 0.4960157178455921
Energy: 0.5951730223706618
Energy: 0.5099415255264671
Energy: 0.5031847751867434
Energy: 0.5115504163370483
Energy: 0.5103040626727864
Energy: 0.5094428055622159
Energy: 0.4122390702743399
Energy: 0.5106860035255069
Energy: 0.5589953686059498
Energy: 0.4594270724039155
Energy: 0.5101618201651369
Energy: 0.4592963253627882
Energy: 0.4148180751683035
Energy: 0.5099048386043183
Energy: 0.5095480849259874
Energy: 0.41552866530953114
Energy: 0.5124584716161702
Energy: 0.5589912232103688
Energy: 0.6067667656489195
Energy: 0.44776552549792226
Energy: 0.5075404925391239
Energy: 0.5109084398293479
Energy: 0.412662887600792
Energy: 0.5099363796257359
Energy: 0.5094997396765852
Energy: 0.4226615781235775
Energy: 0.4560711906167198
Energy: 0.5096970466774275
Energy: 0.4211849821990281
Energy: 0.4598418456915838
Energy: 0.4449565338882031
Energy: 0.43740976755345634
Energy: 0.44315871297518816
Energy: 0.44452404814478874
Energy: 0.4398927318124706
Energy: 0.44253644260353364
Energy: 0.39836546311425525
Energy: 0.44085186992193315
Energy: 0.4427239936422969
Energy: 0.41958990435467675
Energy: 0.4484846390617656
Energy: 0.4198254468415958
Energy: 0.4002498666262603
Energy: 0.4363023224789398
Energy: 0.4365478521512094
Energy: 0.4370490797354952
Energy: 0.4373933371542641
Energy: 0.43637123785420906
Energy: 0.406399102540067
Energy: 0.41545557084524837
Energy: 0.41433979293063894
Energy: 0.4161050372906289
Energy: 0.413235001389577
Energy: 0.4180658033167419
Energy: 0.4060480354138075
Energy: 0.4083992092403016
Energy: 0.413459475852969
Energy: 0.4061873439248648
Energy: 0.408628303650576
Energy: 0.4130523166465833
Energy: 0.40923568788994946
Energy: 0.4107301725154304
Energy: 0.41120353596598663
Energy: 0.4101098524748481
Energy: 0.4107653048741043
Energy: 0.4102016859815887
Energy: 0.4060110781406097
Energy: 0.4109749946944374
Energy: 0.41116723430999985
Energy: 0.41196610234176323
Energy: 0.41085527034426084
Energy: 0.4114901408203591
Energy: 0.4123924064983452
Energy: 0.409619993963838
Energy: 0.40616085183554623
Energy: 0.41282361461813155
Energy: 0.40648654855213423
Energy: 0.4059221060817709
Energy: 0.4144006604775081
Energy: 0.4208770011860352
Energy: 0.4156971139173776
Energy: 0.4144146997946804
Energy: 0.41532145894302125
Energy: 0.4158671348498572
Energy: 0.4418682731072499
Energy: 0.4161055953962729
Energy: 0.41544428002399236
Energy: 0.43628944816112875
Energy: 0.4154871655875566
Energy: 0.41632614316595673
Energy: 0.4414945147067821
Energy: 0.4164083490709076
Energy: 0.44336458209140417
Energy: 0.4365720490353383
Energy: 0.41659578169891087
Energy: 0.43685314202102504
Energy: 0.5567272009569075
Energy: 0.43307132973383733
Energy: 0.44014454464241043
Energy: 0.439684115253217
Energy: 0.4087896450998069
Energy: 0.44327018167605553
Energy: 0.4097879889722916
Energy: 0.5095864916235597
Energy: 0.5096789442714063
Energy: 0.4360494679540301
Energy: 0.5109535023766092
Energy: 0.4437047106593189
Energy: 0.4344584445509607
Energy: 0.5049815483991633
Energy: 0.44930771494085103
Energy: 0.4396648594170222
Energy: 0.5096958973607016
Energy: 0.4487083446773929
Energy: 0.5038940320508324
Energy: 0.5099500825236424
Energy: 0.5102168013713344
Energy: 0.44422101081179505
Energy: 0.512673475592482
Energy: 0.4754099002613829
Energy: 0.5682610619098007
Energy: 0.44510188607324724
Energy: 0.5005140246665615
Energy: 0.5103080063301404
Energy: 0.4431371686504748
Energy: 0.5029368124078936
Energy: 0.6066355151618367
Energy: 0.4792706246227648
Energy: 0.44371325687102614
Energy: 0.511433659151553
Energy: 0.4438619600095053
Energy: 0.5095546935387952
Energy: 0.41547665972765857
Energy: 0.5099393563457199
Energy: 0.5032060297524155
Energy: 0.4163001594907689
Energy: 0.5114338599891742
Energy: 0.5532998514086696

minimum gb energy = 0.39836546311425525 eV
minimum distance =  2.6747186941156 Angstroms
sigma value = 57


========================================
theta = 99.36891557845483
========================================

Energy: 0.37998589858292126
Energy: 0.5525930527480678
Energy: 0.4535614740607688
Energy: 0.39683408334446685
Energy: 0.6354289839191292
Energy: 0.45412681815120143
Energy: 0.5453064099812968
Energy: 0.4987393934317381
Energy: 0.41511193418769143
Energy: 0.5010570655318536
Energy: 0.49666023801373665
Energy: 0.44939399975299227
Energy: 0.57652035911565
Energy: 0.3965421766333479
Energy: 0.3968817210979319
Energy: 0.4992122801264827
Energy: 0.3965754753443789
Energy: 0.44186430501850443
Energy: 0.4970020048469447
Energy: 0.3962455580276188
Energy: 0.44060291901039966
Energy: 0.49759797738658007
Energy: 0.4282838305510405
Energy: 0.4504341408875667
Energy: 0.4218775574588016
Energy: 0.4305796604135343
Energy: 0.4149712939998626
Energy: 0.4224961329713541
Energy: 0.42903501298101343
Energy: 0.40921061095841177
Energy: 0.3704163869159254
Energy: 0.42735349495475333
Energy: 0.39534539014918146
Energy: 0.38281749964777845
Energy: 0.4272258232025828
Energy: 0.39547699060709834
Energy: 0.4894629461699197
Energy: 0.43190754938771053
Energy: 0.4270051487806724
Energy: 0.3899142452457962
Energy: 0.43011640194533685
Energy: 0.3880229096997395
Energy: 0.5095968590429409
Energy: 0.38028612888410007
Energy: 0.3798940201578979
Energy: 0.39735231282779004
Energy: 0.38054910589651
Energy: 0.38777477231180935
Energy: 0.39241773575771455
Energy: 0.39507680683344215
Energy: 0.3906343997227739
Energy: 0.39313189069115473
Energy: 0.3949986814839741
Energy: 0.3907375953880902
Energy: 0.39046228876555367
Energy: 0.3783215132876897
Energy: 0.3784045526921046
Energy: 0.3905391885827259
Energy: 0.37833295384476867
Energy: 0.3784512548276664
Energy: 0.38840004044935195
Energy: 0.37423220428601
Energy: 0.37651586264857956
Energy: 0.3756980426395347
Energy: 0.37445132538837256
Energy: 0.377397920836321
Energy: 0.3931818928590245
Energy: 0.3798827254725654
Energy: 0.3742636091069996
Energy: 0.3832741286127826
Energy: 0.3771886345296097
Energy: 0.38083068361724687
Energy: 0.37390922985701264
Energy: 0.3797086927789516
Energy: 0.3820838714251658
Energy: 0.3776657820665265
Energy: 0.3855659304516959
Energy: 0.3822455268064325
Energy: 0.3748710245490044
Energy: 0.3790816015076815
Energy: 0.3741376592581199
Energy: 0.37615903548017393
Energy: 0.38806576596129405
Energy: 0.3743323573375629
Energy: 0.37412615455904374
Energy: 0.3775659633061818
Energy: 0.3774786945015085
Energy: 0.37433822910511266
Energy: 0.37778138744290457
Energy: 0.3768143485927563
Energy: 0.45187585702720784
Energy: 0.3909359012536102
Energy: 0.38174863149090316
Energy: 0.3830788730349868
Energy: 0.3980968495529284
Energy: 0.38153597300370184
Energy: 0.4005629646604372
Energy: 0.39790577704222396
Energy: 0.39065446070579585
Energy: 0.39683803257386036
Energy: 0.3952166358239039
Energy: 0.39651596288638263
Energy: 0.3760415651854102
Energy: 0.3982255744161242
Energy: 0.38963904162270324
Energy: 0.37693742754525156
Energy: 0.39726412767147645
Energy: 0.38755067470826116
Energy: 0.4276872591347708
Energy: 0.39758109684315734
Energy: 0.4284537056752464
Energy: 0.4290052612376118
Energy: 0.4015564223897767
Energy: 0.42713754778586593
Energy: 0.4849755584492705
Energy: 0.398574558213616
Energy: 0.39819603562992667
Energy: 0.43538531673543757
Energy: 0.3988227551754559
Energy: 0.41039185592660465
Energy: 0.5379086524656924
Energy: 0.42745908212902234
Energy: 0.42647899246864496
Energy: 0.42881403507678695
Energy: 0.43250317129420834
Energy: 0.41861975383677896
Energy: 0.3748871133013525
Energy: 0.4951140875900886
Energy: 0.4271585439840302
Energy: 0.3902614565908788
Energy: 0.5013712675489532
Energy: 0.4206562321021098
Energy: 0.3941288669783584
Energy: 0.49931467496624754
Energy: 0.48540491554463633
Energy: 0.3941151187950738
Energy: 0.4973137357301424
Energy: 0.46378279481662776
Energy: 0.5570384841397235
Energy: 0.4275051692493277
Energy: 0.4075307946583172
Energy: 0.43042282267280263
Energy: 0.4151162862282737
Energy: 0.42676838788054927
Energy: 0.5781098957144218
Energy: 0.4154279301034863
Energy: 0.42282717765692684
Energy: 0.4949195126453209
Energy: 0.4154780899344774
Energy: 0.4690716747071824
Energy: 0.5761233008521092
Energy: 0.5006541367573623
Energy: 0.4813856073608965
Energy: 0.49927264118362036
Energy: 0.49862527644506494
Energy: 0.42643903098024244
Energy: 0.3786312066717443
Energy: 0.47219092586797623
Energy: 0.4510908710233084
Energy: 0.4006178445458338
Energy: 0.5028614005721272
Energy: 0.4409614351110237

minimum gb energy = 0.3704163869159254 eV
minimum distance =  2.69517568876376 Angstroms
sigma value = 43


========================================
theta = 102.11511746203723
========================================

Energy: 0.32868225744675117
Energy: 0.4574469223559225
Energy: 0.4002661733289744
Energy: 0.3452525547657
Energy: 0.5271554304323199
Energy: 0.3856141630796065
Energy: 0.47583526229102263
Energy: 0.3739192696347219
Energy: 0.34606419033519675
Energy: 0.4186688400303238
Energy: 0.3865780335899271
Energy: 0.3426165225133849
Energy: 0.5002784049374648
Energy: 0.3322628002526056
Energy: 0.3360406444227375
Energy: 0.4385958084867099
Energy: 0.33204553729902736
Energy: 0.33227828931733794
Energy: 0.43050472464085576
Energy: 0.3417003238356891
Energy: 0.3474554536013677
Energy: 0.37818776768395157
Energy: 0.36069533027950784
Energy: 0.38647667880098885
Energy: 0.4064176270652074
Energy: 0.3529278105468228
Energy: 0.34612815694868887
Energy: 0.3678835846150395
Energy: 0.38768896673079534
Energy: 0.34429605567179533
Energy: 0.31736979196486376
Energy: 0.38564116747009014
Energy: 0.33625281302669924
Energy: 0.3218078293893283
Energy: 0.38553972658478314
Energy: 0.3361387074385811
Energy: 0.43032038442389803
Energy: 0.3855509963443848
Energy: 0.3854795203025053
Energy: 0.3459603114269073
Energy: 0.3858749023522995
Energy: 0.32647056707854444
Energy: 0.45126812777001846
Energy: 0.3174202454500226
Energy: 0.322404010339224
Energy: 0.3463618577407332
Energy: 0.3175977520349243
Energy: 0.322121571445113
Energy: 0.35464928997138995
Energy: 0.3228641508098808
Energy: 0.3532640449387611
Energy: 0.3558085471167216
Energy: 0.32495478055501326
Energy: 0.35318184996368596
Energy: 0.3535140789161721
Energy: 0.3168570811293347
Energy: 0.31859110917783107
Energy: 0.35347578015406245
Energy: 0.31741480684061474
Energy: 0.3184385242942593
Energy: 0.3144678834822346
Energy: 0.3330305979344652
Energy: 0.31647529725883505
Energy: 0.3127571843601488
Energy: 0.3333288887956825
Energy: 0.3134153532682492
Energy: 0.3563899581884218
Energy: 0.3331768988433926
Energy: 0.3331636080567522
Energy: 0.31698435427495386
Energy: 0.33314138954917144
Energy: 0.3158411149278059
Energy: 0.43120790825650446
Energy: 0.33211088741427713
Energy: 0.3330567912175947
Energy: 0.3514930805249057
Energy: 0.3094603966423755
Energy: 0.3519890594286044
Energy: 0.32126206746290387
Energy: 0.32179704560388805
Energy: 0.32125414416942244
Energy: 0.322345446945946
Energy: 0.3157052983274139
Energy: 0.3214013966345506
Energy: 0.3212802319006501
Energy: 0.31062156240165456
Energy: 0.3107042180472149
Energy: 0.32130307954286436
Energy: 0.31068132063871323
Energy: 0.31190930540860606
Energy: 0.3178095480477716
Energy: 0.31585258789998866
Energy: 0.3161270840574612
Energy: 0.30948411034859225
Energy: 0.31590330822811213
Energy: 0.3089512403919366
Energy: 0.32313917542725007
Energy: 0.3158171265706887
Energy: 0.31597255918687994
Energy: 0.3228452762220504
Energy: 0.31580078830135316
Energy: 0.3113022702690743
Energy: 0.3159994950763844
Energy: 0.3109530756854025
Energy: 0.31232781378172153
Energy: 0.31595345041826106
Energy: 0.3108820086121777
Energy: 0.3119129284022714
Energy: 0.3158543274919667
Energy: 0.31884215302917907
Energy: 0.3159071545826873
Energy: 0.31640482252077573
Energy: 0.35480481224572347
Energy: 0.3158257637231529
Energy: 0.31599853184625726
Energy: 0.31603784363984677
Energy: 0.3157772390900223
Energy: 0.3172331999323979
Energy: 0.31405057248607887
Energy: 0.3157847081028456
Energy: 0.33496489870657237
Energy: 0.32140357444914197
Energy: 0.3213865723973775
Energy: 0.3148492371796834
Energy: 0.3212610496844151
Energy: 0.3155386879641837
Energy: 0.31651148101683596
Energy: 0.3213560587823752
Energy: 0.3215420889828436
Energy: 0.3116490757978858
Energy: 0.32155757965496473
Energy: 0.3107377574174307
Energy: 0.3330345708369745
Energy: 0.31106746123803924
Energy: 0.3114748354768987
Energy: 0.333061731450031
Energy: 0.31161006814449016
Energy: 0.31221664517609593
Energy: 0.3332680746420142
Energy: 0.33189874643721207
Energy: 0.33301495760825295
Energy: 0.33440466837536204
Energy: 0.3216170338703722
Energy: 0.332996869761955
Energy: 0.43995451101768257
Energy: 0.334779915131513
Energy: 0.31608166763367834
Energy: 0.3397693198337187
Energy: 0.3138690005942853
Energy: 0.33914781224803175
Energy: 0.4123476281913699
Energy: 0.35338971261482693
Energy: 0.3532822623864841
Energy: 0.3173403572622148
Energy: 0.3534946907830104
Energy: 0.31632482846644894
Energy: 0.3166432716822952
Energy: 0.35329920320388536
Energy: 0.3315209114265624
Energy: 0.31748183583883516
Energy: 0.35315291541957994
Energy: 0.31964950049755275
Energy: 0.3525991514917053
Energy: 0.330958171018665
Energy: 0.3287124070998972
Energy: 0.3658962034377355
Energy: 0.346997116171402
Energy: 0.32684821513934714
Energy: 0.38722171770714603
Energy: 0.3317300972790522
Energy: 0.3855727745283969
Energy: 0.38818589555323274
Energy: 0.33307192961008864
Energy: 0.38550805696905016
Energy: 0.47096858722438134
Energy: 0.3253220302828708
Energy: 0.3313881667762086
Energy: 0.386218069260862
Energy: 0.3251444663827232
Energy: 0.3312492296411386
Energy: 0.4658127370180044
Energy: 0.3740648808203364
Energy: 0.37410057368535915
Energy: 0.3859204125770803
Energy: 0.39121182419234707
Energy: 0.37092957198018206
Energy: 0.3224505290652117
Energy: 0.4127736180711014
Energy: 0.3598405924903047
Energy: 0.32932648083060684
Energy: 0.43884977142759957
Energy: 0.34728854372013535
Energy: 0.42938634569551853
Energy: 0.38881570921318925
Energy: 0.38398384677207875
Energy: 0.3763043223721111
Energy: 0.4407232127809215
Energy: 0.3725253295287044
Energy: 0.46535891255503775
Energy: 0.3476969811241938
Energy: 0.3507018859708947
Energy: 0.37817295527237155
Energy: 0.3819716215417753
Energy: 0.4095112030679275
Energy: 0.4989967436554255
Energy: 0.34307145518986226
Energy: 0.3582265355518478
Energy: 0.4386867552599599
Energy: 0.3455079080264634
Energy: 0.3783178985834186
Energy: 0.4568893328735345
Energy: 0.3890129350986274
Energy: 0.38397480834323044
Energy: 0.4186494456308177
Energy: 0.44112525205744624
Energy: 0.38015669688240294

minimum gb energy = 0.3089512403919366 eV
minimum distance =  2.69637785315641 Angstroms
sigma value = 81


========================================
theta = 109.47122063449069
========================================

Energy: 0.012872675160871108
Energy: 0.03854056015791883
Energy: 0.013534585767901525
Energy: 0.014314623528960275
Energy: 0.013585170482716227
Energy: 0.013263917112827471
Energy: 0.03884374234645854
Energy: 0.01359539702342236
Energy: 0.01357111878035853
Energy: 0.037993807924351294
Energy: 0.015004887760377294
Energy: 0.01369493374128494
Energy: 0.037702648495872654
Energy: 0.013295160087571194
Energy: 0.013257472695854441
Energy: 0.03764033478077219
Energy: 0.013196639587528642
Energy: 0.03828520319825142
Energy: 0.01552576232043561
Energy: 0.013335056876349583
Energy: 0.013336612405475777
Energy: 0.015408942118852027
Energy: 0.013250553831056682
Energy: 0.038507090050351814
Energy: 0.03820388055653312
Energy: 0.03769361886208682
Energy: 0.03777894504978265
Energy: 0.03879954122269773
Energy: 0.03778220046028472
Energy: 0.03780754416433798
Energy: 0.013700617585245635
Energy: 0.01346996913027693
Energy: 0.013178548870504132
Energy: 0.014721884182905353
Energy: 0.013595441203291304
Energy: 0.01335041426778283
Energy: 0.037955743970073424
Energy: 0.013586532567806654
Energy: 0.013667141628102045
Energy: 0.03771550222146886
Energy: 0.01362378273115153
Energy: 0.013702087736827838
Energy: 0.03777896744620146
Energy: 0.013349181329867392
Energy: 0.013462012840701107
Energy: 0.0377219518320135
Energy: 0.013221136954351701
Energy: 0.03963460043424379
Energy: 0.014184122808855315
Energy: 0.013259602734259779
Energy: 0.03880367736930989
Energy: 0.01517280082647693
Energy: 0.013402235830861057
Energy: 0.03944004846996426
Energy: 0.013235479606595196
Energy: 0.037629173606959825
Energy: 0.0377061243111603
Energy: 0.013252361124352331
Energy: 0.0376277629818809
Energy: 0.03764992033072502

minimum gb energy = 0.012872675160871108 eV
minimum distance =  2.84586434018327 Angstroms
sigma value = 3


========================================
theta = 117.56060310526324
========================================

Energy: 0.4013574346924185
Energy: 0.41050282489341616
Energy: 0.390819457119639
Energy: 0.3723169345304939
Energy: 0.3869666855160938
Energy: 0.3495851600610157
Energy: 0.3990487976271513
Energy: 0.37649679492183247
Energy: 0.3756611211907966
Energy: 0.38993767165618726
Energy: 0.4056124427979822
Energy: 0.34474899757083316
Energy: 0.4134973629829434
Energy: 0.36296819132435965
Energy: 0.36243181495533805
Energy: 0.3964472424067056
Energy: 0.36378992946414945
Energy: 0.3850851346517875
Energy: 0.37417570675925743
Energy: 0.36446000148966834
Energy: 0.3619527168985113
Energy: 0.3739164512561403
Energy: 0.33292968940253703
Energy: 0.39162204801899037
Energy: 0.34057028564482555
Energy: 0.3762049101666019
Energy: 0.4105438286942353
Energy: 0.3405817470984647
Energy: 0.3989591734755757
Energy: 0.3774875877257061
Energy: 0.3352938568792444
Energy: 0.3600682008178386
Energy: 0.3663277251719371
Energy: 0.31529562216385765
Energy: 0.35993840709292424
Energy: 0.33410086564318076
Energy: 0.38777065921428705
Energy: 0.34750797133269395
Energy: 0.34728344092275937
Energy: 0.38750091941714887
Energy: 0.35096244634006135
Energy: 0.3791330481438503
Energy: 0.37329141660315773
Energy: 0.34223748584848374
Energy: 0.3415189701057805
Energy: 0.37360916916529274
Energy: 0.3371002335288315
Energy: 0.3419390364880464
Energy: 0.3225338585999778
Energy: 0.35786911701155516
Energy: 0.3929357748843519
Energy: 0.3963269672643243
Energy: 0.31876099180401124
Energy: 0.34748150005392436
Energy: 0.3238067416667757
Energy: 0.3482651996877821
Energy: 0.34805533560422985
Energy: 0.3241991013420084
Energy: 0.3494574534877286
Energy: 0.3475400724938025
Energy: 0.3057826969778358
Energy: 0.3494068813885081
Energy: 0.34882476470942453
Energy: 0.30478167618427265
Energy: 0.30810039677719747
Energy: 0.34605377325958914
Energy: 0.32565884439048537
Energy: 0.38570799266847533
Energy: 0.3841970251253796
Energy: 0.3235208709578254
Energy: 0.3213930020955728
Energy: 0.32301774667938343
Energy: 0.32421706934597155
Energy: 0.3558043074869157
Energy: 0.36748930349496434
Energy: 0.3259239176824204
Energy: 0.29674150627775875
Energy: 0.3253379358837525
Energy: 0.3016117958904735
Energy: 0.3376108625052503
Energy: 0.37034359048493537
Energy: 0.3262113665141359
Energy: 0.3078325042525356
Energy: 0.37107147426846193
Energy: 0.2998003770991109
Energy: 0.30746808940561404
Energy: 0.3074164650714601
Energy: 0.2995770126554981
Energy: 0.30894602528548876
Energy: 0.3072270200475889
Energy: 0.3014278310554839
Energy: 0.35895944843044697
Energy: 0.3594724468807787
Energy: 0.359318154774542
Energy: 0.36700074703447266
Energy: 0.35930212552321605
Energy: 0.3028121636614563
Energy: 0.3602678922923059
Energy: 0.3589998705888083
Energy: 0.3029229238322664
Energy: 0.30992070635511104
Energy: 0.29880404597981314
Energy: 0.29915982084297676
Energy: 0.35517749786236086
Energy: 0.35533225013073955
Energy: 0.29948400739594705
Energy: 0.300959292539005
Energy: 0.355935406720996
Energy: 0.3729279428012224
Energy: 0.33155541185081683
Energy: 0.35632326696492933
Energy: 0.299866364465088
Energy: 0.3007554506900905
Energy: 0.35503612208004576
Energy: 0.36710794224665205
Energy: 0.2987337265187795
Energy: 0.29853450869686604
Energy: 0.3672834463617285
Energy: 0.3018704063265384
Energy: 0.29843772775099753
Energy: 0.3655990369144119
Energy: 0.35900359416853034
Energy: 0.35994638643211085
Energy: 0.36697699577590326
Energy: 0.3711119939097214
Energy: 0.35934970879740646
Energy: 0.3146469006724361
Energy: 0.3591208996018643
Energy: 0.30969797152090867
Energy: 0.30831922821673957
Energy: 0.3593265604340513
Energy: 0.3083168293141197
Energy: 0.30679006902743233
Energy: 0.3731160470298418
Energy: 0.37359247040587407
Energy: 0.30683739035496765
Energy: 0.3734177754796414
Energy: 0.36906542257603014
Energy: 0.30147005170967145
Energy: 0.3255806330453817
Energy: 0.32548600938597816
Energy: 0.33844655783142724
Energy: 0.3256614339555853
Energy: 0.3130891936630154
Energy: 0.3081627118494684
Energy: 0.3237419735237394
Energy: 0.3234676464671736
Energy: 0.3073253716130916
Energy: 0.3260739848979353
Energy: 0.32313059188644977
Energy: 0.3121760892339918
Energy: 0.37110203159142785
Energy: 0.3336913185608056
Energy: 0.30861272597760186
Energy: 0.35644974260858
Energy: 0.3475255903833111
Energy: 0.3488391594515533
Energy: 0.370809347401056
Energy: 0.332227578442701
Energy: 0.3481596562822848
Energy: 0.31594886256812127
Energy: 0.34783730200012203
Energy: 0.3307023600434501
Energy: 0.3632056292042809
Energy: 0.36133908632444206
Energy: 0.33069882974390197
Energy: 0.3634193058037592
Energy: 0.3964106305618977
Energy: 0.30916914005978946
Energy: 0.374328327576126
Energy: 0.35864817892287415
Energy: 0.3086074785784796
Energy: 0.37396824036628534
Energy: 0.3271401560046787
Energy: 0.3470760057459842
Energy: 0.3808243561350339
Energy: 0.3812418484307869
Energy: 0.34706123852187193
Energy: 0.3871796230453855
Energy: 0.3764134602894147
Energy: 0.38091849102416814
Energy: 0.35094182309630895
Energy: 0.34955660234281316
Energy: 0.38081055070594116
Energy: 0.30392522237289066
Energy: 0.35061398192598
Energy: 0.41294697790075374
Energy: 0.34475486490161134
Energy: 0.3983803947628033
Energy: 0.4014955805429232
Energy: 0.32533211035189613
Energy: 0.3450921431985111
Energy: 0.3491383690305699
Energy: 0.37451522444064367
Energy: 0.37408167324898295
Energy: 0.3491376740098192
Energy: 0.3771706820030224
Energy: 0.3702314713171807

minimum gb energy = 0.29674150627775875 eV
minimum distance =  2.672963565559 Angstroms
sigma value = 67


========================================
theta = 121.00758300686714
========================================

Energy: 0.48530143266365006
Energy: 0.4815606867497519
Energy: 0.4685605567265005
Energy: 0.3917779772340412
Energy: 0.47937342765400126
Energy: 0.4805615931167847
Energy: 0.45884109663315725
Energy: 0.4829341941603607
Energy: 0.47519326731058364
Energy: 0.46835931880327875
Energy: 0.4809269725136242
Energy: 0.44189928595860817
Energy: 0.48231299082760437
Energy: 0.44122553314483237
Energy: 0.4290060032413212
Energy: 0.47080851723771283
Energy: 0.4416256314372049
Energy: 0.47126417245968244
Energy: 0.44544912812183407
Energy: 0.4319466383925089
Energy: 0.4299718886610084
Energy: 0.44601812509907074
Energy: 0.40244565252815834
Energy: 0.4296942898815411
Energy: 0.4406187348481148
Energy: 0.4823267207270936
Energy: 0.4411885623877741
Energy: 0.44069176854090897
Energy: 0.48052043864201144
Energy: 0.44297740553428383
Energy: 0.45753336449394305
Energy: 0.42981651290454126
Energy: 0.44033057555738075
Energy: 0.4070847357822496
Energy: 0.4299267151982105
Energy: 0.4387984545018407
Energy: 0.44602220782326024
Energy: 0.40600683152300876
Energy: 0.4056254047499776
Energy: 0.44645605142938083
Energy: 0.4070003280970917
Energy: 0.4061782570815224
Energy: 0.44877931034841284
Energy: 0.42030610418061987
Energy: 0.4045138316588982
Energy: 0.4458376417902162
Energy: 0.3832108677907371
Energy: 0.4457461703339179
Energy: 0.38554283471960016
Energy: 0.42842200469905006
Energy: 0.42554836973358595
Energy: 0.42633307931164144
Energy: 0.4046230241683008
Energy: 0.4259685480389958
Energy: 0.3827686174529999
Energy: 0.4092890273512785
Energy: 0.4045683276608382
Energy: 0.3833235861217925
Energy: 0.4067015937975329
Energy: 0.4049693451695879
Energy: 0.3817509771847725
Energy: 0.4117106739928775
Energy: 0.4059445920394488
Energy: 0.383297803340172
Energy: 0.4560688445934442
Energy: 0.4060239711723612
Energy: 0.38480199562259476
Energy: 0.45459168344526907
Energy: 0.45429403994247514
Energy: 0.3855260970468279
Energy: 0.4248765036448895
Energy: 0.38253527918361757
Energy: 0.38572246251508474
Energy: 0.4535551063814741
Energy: 0.45150575291673317
Energy: 0.38632444967866153
Energy: 0.3841570264371237
Energy: 0.38238668008312543
Energy: 0.40039411778454526
Energy: 0.42405023034709477
Energy: 0.45020486610392296
Energy: 0.3828623124013844
Energy: 0.41791300760918487
Energy: 0.4510650316160872
Energy: 0.4196371398324585
Energy: 0.3857532230172854
Energy: 0.38219972031406796
Energy: 0.4192235173277213
Energy: 0.38309497942468224
Energy: 0.3821977145503947
Energy: 0.41949325961736794
Energy: 0.45905871067904913
Energy: 0.45632146856697664
Energy: 0.42528953415385373
Energy: 0.38228761039109843
Energy: 0.45462156166363904
Energy: 0.4099453910012044
Energy: 0.41508207527622554
Energy: 0.3880847911994338
Energy: 0.4105762325546979
Energy: 0.3774324707486497
Energy: 0.4067197248956491
Energy: 0.405648883667735
Energy: 0.42593478158307974
Energy: 0.42574504223275217
Energy: 0.40540162966706056
Energy: 0.4254726133679086
Energy: 0.4054641314021726
Energy: 0.3755373937428813
Energy: 0.38557517655052387
Energy: 0.42399688465607055
Energy: 0.39007835012463765
Energy: 0.38403044596585467
Energy: 0.4206307430463642
Energy: 0.4055677591553932
Energy: 0.44650230743481856
Energy: 0.40691694718326715
Energy: 0.4053657707898705
Energy: 0.4455705074023321
Energy: 0.4094162983267636
Energy: 0.40797926330577944
Energy: 0.4567036020307829
Energy: 0.38872699175987363
Energy: 0.4075340343551471
Energy: 0.4588761787027004
Energy: 0.38858715128235277
Energy: 0.4820918284566379
Energy: 0.4181272553194332
Energy: 0.38856986713895286
Energy: 0.4720433275868089
Energy: 0.4282424010080299
Energy: 0.4254015829208466
Energy: 0.4734704443449422
Energy: 0.44676624255817604
Energy: 0.4422292575544598
Energy: 0.47766533751175044
Energy: 0.4458227963992598
Energy: 0.4074644084624895

minimum gb energy = 0.3755373937428813 eV
minimum distance =  2.67047245857489 Angstroms
sigma value = 33


========================================
theta = 124.1232945407953
========================================

Energy: 0.5664577572830355
Energy: 0.560509653090449
Energy: 0.561172389143386
Energy: 0.4796944744615486
Energy: 0.49104711894846015
Energy: 0.5296650481567411
Energy: 0.5120470889158709
Energy: 0.48266875187924546
Energy: 0.48295916383575754
Energy: 0.481617363189687
Energy: 0.4830106087837129
Energy: 0.441312910341863
Energy: 0.5523092496797616
Energy: 0.44022487039449454
Energy: 0.43813592091342823
Energy: 0.4869496655307814
Energy: 0.48164510068714156
Energy: 0.4817146558908798
Energy: 0.48202920999804577
Energy: 0.5097687439311056
Energy: 0.43951767721346985
Energy: 0.48215470467871685
Energy: 0.43917867205923355
Energy: 0.43968126930184664
Energy: 0.48160950086924664
Energy: 0.48321994966399906
Energy: 0.4829781330921839
Energy: 0.48165096008967656
Energy: 0.4829740602444044
Energy: 0.4408794254082851
Energy: 0.4333032567827338
Energy: 0.4356461968736408
Energy: 0.43661848808240905
Energy: 0.43641033886327735
Energy: 0.43583248893832227
Energy: 0.4796055275223548
Energy: 0.4819176212727544
Energy: 0.43508980582060697
Energy: 0.4357076975546977
Energy: 0.48199047372969345
Energy: 0.4356865642742843
Energy: 0.4402712307805057
Energy: 0.48730694576479483
Energy: 0.4342540617167333
Energy: 0.44132246343118936
Energy: 0.4880492774997699
Energy: 0.4367421650424464
Energy: 0.48556559794164417
Energy: 0.4340643789772062
Energy: 0.48454982016669507
Energy: 0.44252145297998635
Energy: 0.4411532452397182
Energy: 0.43427889333706954
Energy: 0.4433611279504753
Energy: 0.4340207581929182
Energy: 0.43876340877785397
Energy: 0.43431806593421063
Energy: 0.43430887642719695
Energy: 0.43533990630275576
Energy: 0.43401531719501535
Energy: 0.4637846647067774
Energy: 0.4352404800937258
Energy: 0.4344438555242886
Energy: 0.4365850781502969
Energy: 0.43482634080606697
Energy: 0.5064268762241061
Energy: 0.4338033797396959
Energy: 0.46605768321362506
Energy: 0.43399568652758064
Energy: 0.4338601378867396
Energy: 0.5064117355968834
Energy: 0.4341386898831703
Energy: 0.43393160256055285
Energy: 0.4703322706525551
Energy: 0.434512758590446
Energy: 0.4339390594028226
Energy: 0.44142283221132744
Energy: 0.4344078963200856
Energy: 0.42043531294383596
Energy: 0.4409949113382655
Energy: 0.4411662400314979
Energy: 0.42298193709701604
Energy: 0.46525543204977055
Energy: 0.44671222589955256
Energy: 0.4205497735770534
Energy: 0.4821495988764447
Energy: 0.48292271995161046
Energy: 0.42053525706475975
Energy: 0.4840996847848534
Energy: 0.44069273614405235
Energy: 0.4416163098699817
Energy: 0.4936175971891758
Energy: 0.42013474659557803
Energy: 0.44203848982453287
Energy: 0.4461385177885262
Energy: 0.4393288956787437
Energy: 0.5662337242920182
Energy: 0.4459787888856695
Energy: 0.4551381143437724
Energy: 0.5664066221450611
Energy: 0.4487646455374745
Energy: 0.4725324606500293
Energy: 0.553881660682541
Energy: 0.48216443807225867
Energy: 0.4817987279080107
Energy: 0.4821924086259731
Energy: 0.48210632269722453
Energy: 0.5304875822873066
Energy: 0.5343766676566489
Energy: 0.4865368886944511
Energy: 0.4463060642432768
Energy: 0.4488639001073513
Energy: 0.4854848034616932
Energy: 0.46930388680642204
Energy: 0.5125652780768809
Energy: 0.48267382455904745
Energy: 0.48418217678752035
Energy: 0.5127589865423388
Energy: 0.48333566130621913
Energy: 0.48288725422308293
Energy: 0.5534037542360687
Energy: 0.5099606513650432
Energy: 0.438283378207227
Energy: 0.48569310042785
Energy: 0.4890536363436227
Energy: 0.48153402428217196
Energy: 0.4817999570852889
Energy: 0.4400848831513522
Energy: 0.43857855455035627
Energy: 0.48189405914241573
Energy: 0.4794583324769435
Energy: 0.4402899836728003
Energy: 0.4816875297136643
Energy: 0.4829055833395452
Energy: 0.44066103365665754
Energy: 0.4816065553283962
Energy: 0.48257232925692556
Energy: 0.4415501385819533
Energy: 0.4339551634506456
Energy: 0.4353632874901591
Energy: 0.43529772874299366
Energy: 0.43478649121353996
Energy: 0.4351362556251697
Energy: 0.49286228137283034
Energy: 0.4821391750316944
Energy: 0.4351607491442307
Energy: 0.43579243825043684
Energy: 0.48221604944440144
Energy: 0.4359492520834576
Energy: 0.44036115326362424
Energy: 0.4859210164434113
Energy: 0.43421481623827807
Energy: 0.44147616328454137
Energy: 0.48679537662948597
Energy: 0.436553466538419
Energy: 0.4847243037470886
Energy: 0.4354263668181587
Energy: 0.43446805203519084
Energy: 0.4431148206308019
Energy: 0.43423686648713733
Energy: 0.4475884362892187
Energy: 0.4424824014895727
Energy: 0.4342087092583581
Energy: 0.43440891111070357
Energy: 0.4343772574552094
Energy: 0.43491851209740495
Energy: 0.4361092389319224
Energy: 0.4341614809304531
Energy: 0.46346772936583835
Energy: 0.43424289078834694
Energy: 0.43510949767063295
Energy: 0.43763418436741847
Energy: 0.4344752524740932
Energy: 0.43494187235657034
Energy: 0.4340597785952007
Energy: 0.4344836923433841
Energy: 0.4347460677634068
Energy: 0.43407423701880765
Energy: 0.5046049374101842
Energy: 0.43429885878114943
Energy: 0.4340180192412159
Energy: 0.4700316958218618
Energy: 0.4346765538043165
Energy: 0.43385028338760745
Energy: 0.4416229970051239
Energy: 0.43438648874140007
Energy: 0.4206053396356535
Energy: 0.44019920052744704
Energy: 0.44132509742315135
Energy: 0.42244606147607355
Energy: 0.46322316773327493
Energy: 0.4467977727044527
Energy: 0.42077543743852386
Energy: 0.48159092032233897
Energy: 0.4822876121589496
Energy: 0.4207145929659822
Energy: 0.4855682650060654
Energy: 0.4402476049172618
Energy: 0.4411323004357262
Energy: 0.4939475901115013
Energy: 0.4365335718636709
Energy: 0.44125749442598683
Energy: 0.4463124297158237
Energy: 0.44219980588744956
Energy: 0.564521213327106
Energy: 0.44612098307833303
Energy: 0.4222311558249551
Energy: 0.5649476364313198
Energy: 0.4196357723537531
Energy: 0.47255487114368544
Energy: 0.5559156707592592
Energy: 0.48179225863496666
Energy: 0.4818809328779422
Energy: 0.4818768062238068
Energy: 0.4816448697575589
Energy: 0.44104830306712156
Energy: 0.533200156512553
Energy: 0.48711198795831717
Energy: 0.44627645871022303
Energy: 0.4477376245135395
Energy: 0.4869827698696073
Energy: 0.46990779075238714

minimum gb energy = 0.4196357723537531 eV
minimum distance =  2.67088345570409 Angstroms
sigma value = 41


========================================
theta = 129.5211963586422
========================================

Energy: 0.6946736956432042
Energy: 0.6800834589102857
Energy: 0.5706774683125044
Energy: 0.5425441166629995
Energy: 0.523308964207281
Energy: 0.572021468182347
Energy: 0.5381062699874852
Energy: 0.5110369771342178
Energy: 0.5111195097820962
Energy: 0.5247379719494811
Energy: 0.5109986197834884
Energy: 0.5098825422316565
Energy: 0.5886604784842103
Energy: 0.5090247450042042
Energy: 0.5094558299253807
Energy: 0.5872393834594254
Energy: 0.509893898551037
Energy: 0.5092001240919904
Energy: 0.5224875164646772
Energy: 0.48892896472295755
Energy: 0.4887275126041487
Energy: 0.5224861520061728
Energy: 0.48903081436418006
Energy: 0.510091299787537
Energy: 0.5090158647253966
Energy: 0.5113718530107336
Energy: 0.5105254014127995
Energy: 0.5091256553180681
Energy: 0.5737089398176403
Energy: 0.5013209156714994
Energy: 0.5367047499095193
Energy: 0.5450750707608087
Energy: 0.5459812659621841
Energy: 0.49115888571622984
Energy: 0.5451440369680662
Energy: 0.5091128740062276
Energy: 0.5084654105178279
Energy: 0.5014558285251651
Energy: 0.5000116968194308
Energy: 0.5084972920704578
Energy: 0.5015203468557551
Energy: 0.5094130874329772
Energy: 0.510201149868512
Energy: 0.4895325456246351
Energy: 0.5092576263591491
Energy: 0.5110673349305955
Energy: 0.4917825911207953
Energy: 0.5086878529768358
Energy: 0.5722898290362525
Energy: 0.5830275104358743
Energy: 0.4905391194358255
Energy: 0.47787477226548314
Energy: 0.5093590927728603
Energy: 0.4888501809679124
Energy: 0.5352186542908098
Energy: 0.5126936916489526
Energy: 0.5087000948539723
Energy: 0.5270865707110848
Energy: 0.5094334766532932
Energy: 0.5103061097945313
Energy: 0.5214628458393216
Energy: 0.5092618870453738
Energy: 0.48946009304088706
Energy: 0.4894515622250696
Energy: 0.47665217811079785
Energy: 0.48960532697547743
Energy: 0.5872246837924348
Energy: 0.5397095021701735
Energy: 0.5401879739256557
Energy: 0.5875349528855641
Energy: 0.4765265530359689
Energy: 0.5640216140631142
Energy: 0.5994631879530803
Energy: 0.5092391487884723
Energy: 0.5230207705183202
Energy: 0.5231127001089498
Energy: 0.5124195578915226
Energy: 0.5096408645904239
Energy: 0.5917017755004748
Energy: 0.5228356641237072
Energy: 0.47691768066059337
Energy: 0.480539386966028
Energy: 0.5227033392320705
Energy: 0.47672955980535864

minimum gb energy = 0.4765265530359689 eV
minimum distance =  2.70261572018834 Angstroms
sigma value = 11


========================================
theta = 135.99657265110037
========================================

Energy: 0.8690276234639919
Energy: 0.58560652462662
Energy: 0.6059880205003471
Energy: 0.6536891222264635
Energy: 0.5995942933648678
Energy: 0.6482854195842869
Energy: 0.6386966997567792
Energy: 0.5569265169144286
Energy: 0.5570465714373508
Energy: 0.6057482921012861
Energy: 0.5568140046334811
Energy: 0.5573312751284546
Energy: 0.6688125782954601
Energy: 0.5883867942898509
Energy: 0.5879776628716712
Energy: 0.6692277910464451
Energy: 0.5722463199565692
Energy: 0.5902020595756223
Energy: 0.5996150168291853
Energy: 0.5444475798687393
Energy: 0.573462302310181
Energy: 0.5767451951476434
Energy: 0.5743101897787594
Energy: 0.5730679026581291
Energy: 0.6035997815810326
Energy: 0.5578700400841645
Energy: 0.5568705505797934
Energy: 0.5781601419553408
Energy: 0.5571399827461044
Energy: 0.5565786392244241
Energy: 0.6006420479456657
Energy: 0.5679093136439454
Energy: 0.5675406169026632
Energy: 0.556852907979059
Energy: 0.567805312475501
Energy: 0.5778501181010894
Energy: 0.5674513949814273
Energy: 0.5694360680393991
Energy: 0.569536069157601
Energy: 0.5674818257720663
Energy: 0.5584326635412139
Energy: 0.567786876038174
Energy: 0.5632936402940936
Energy: 0.6028850355657938
Energy: 0.5571400054758979
Energy: 0.558097342461475
Energy: 0.607385626458233
Energy: 0.5569453080016014
Energy: 0.5744146754088335
Energy: 0.5892977430362001
Energy: 0.5898023096714604
Energy: 0.5767965882659841
Energy: 0.5731075950084722
Energy: 0.5479531666251899
Energy: 0.5594923619867462
Energy: 0.5902224048919994
Energy: 0.5899467738308553
Energy: 0.5758211783073638
Energy: 0.615575662765815
Energy: 0.5478506699216202
Energy: 0.5631520108333823
Energy: 0.5794340999396481
Energy: 0.5571478617349788
Energy: 0.5579345470031486
Energy: 0.571077531119486
Energy: 0.5567524680648627
Energy: 0.5605085950197701
Energy: 0.5972243085065169
Energy: 0.6223872960306965
Energy: 0.5609954640310002
Energy: 0.6125876336871504
Energy: 0.6165635153075854
Energy: 0.5563700578133981
Energy: 0.6021887903422867
Energy: 0.5939769531799306
Energy: 0.5563898898671968
Energy: 0.6049806840554409
Energy: 0.5573942375278218
Energy: 0.5809547811887952
Energy: 0.6745122063276175
Energy: 0.6260587278635045
Energy: 0.5772843464719479
Energy: 0.6684744836078934
Energy: 0.5878193854212262
Energy: 0.5459357075667993
Energy: 0.5465441677266536
Energy: 0.5456760961707829
Energy: 0.545993672955781
Energy: 0.5857141177726772
Energy: 0.5458283429623858
Energy: 0.5460216319090828
Energy: 0.5466812769930391
Energy: 0.5457779371439847
Energy: 0.5469745715135595
Energy: 0.5989250648238236
Energy: 0.545761706314645
Energy: 0.5455602555417918
Energy: 0.5467495948139719
Energy: 0.5459140646345824
Energy: 0.545690507925618
Energy: 0.5868322402371845
Energy: 0.5698724799048275
Energy: 0.5819263809499616
Energy: 0.6174259303853579
Energy: 0.5905879699461992
Energy: 0.5723829317688275
Energy: 0.6184678430675832
Energy: 0.5802487476414206
Energy: 0.5727158888295558
Energy: 0.5736176313880349
Energy: 0.5768849832484907
Energy: 0.5727440181626242
Energy: 0.5741681752285157
Energy: 0.5765832666475378
Energy: 0.5979565274674055
Energy: 0.589313898926689
Energy: 0.5902901982652223
Energy: 0.5988448559936669
Energy: 0.5883913326704495
Energy: 0.5831296288279417
Energy: 0.6194947457792438
Energy: 0.5459485126048399
Energy: 0.5826324194507427
Energy: 0.5847229091122806
Energy: 0.5914622241745162
Energy: 0.5778734758409063
Energy: 0.5619221795505265
Energy: 0.5774025428556975
Energy: 0.5783241878315263
Energy: 0.5554090902142496
Energy: 0.5769740216630103
Energy: 0.5764704003869803
Energy: 0.5877950900098594
Energy: 0.5798096364556855
Energy: 0.6195350697697706
Energy: 0.5880024848562575
Energy: 0.6006455318339402
Energy: 0.5870838343541007
Energy: 0.6083301844482275
Energy: 0.5725549055873506
Energy: 0.5646975358035706
Energy: 0.5736237657099141
Energy: 0.5724293908647837
Energy: 0.5726651895655198
Energy: 0.6161297398285989
Energy: 0.5801396287469599
Energy: 0.58125607083662
Energy: 0.6170502853712329
Energy: 0.5589152452277085
Energy: 0.5923905245748086
Energy: 0.6162405565157756
Energy: 0.5469114441042681
Energy: 0.5838124103250514
Energy: 0.5973329965953516
Energy: 0.5458252222925918
Energy: 0.5459439088738326
Energy: 0.614303040258393
Energy: 0.545318281728367
Energy: 0.5454463410699981
Energy: 0.5863210472673358
Energy: 0.5477796995676287
Energy: 0.54604017783141
Energy: 0.6147827182964777
Energy: 0.5834304866751076
Energy: 0.5463872898144191
Energy: 0.5855782203638586
Energy: 0.5460286343282967
Energy: 0.5457980801278618
Energy: 0.6373687339842048
Energy: 0.5827237453370794
Energy: 0.5832750722799435
Energy: 0.6252357752518726
Energy: 0.5705827508456536
Energy: 0.5884382548618354
Energy: 0.6739507870652912
Energy: 0.5568646413215713
Energy: 0.5572183719301644
Energy: 0.6028097076630099
Energy: 0.5565018401794766
Energy: 0.5786598743650567
Energy: 0.6081870575380611
Energy: 0.5608967733380229
Energy: 0.62385596729864
Energy: 0.5889297889870782
Energy: 0.5620952056090157
Energy: 0.5881773087695702

minimum gb energy = 0.5444475798687393 eV
minimum distance =  2.66450433665035 Angstroms
sigma value = 57


========================================
theta = 141.05755873101862
========================================

Energy: 0.7917085696740507
Energy: 0.6516713392698158
Energy: 0.6488037210925932
Energy: 0.6496288226369942
Energy: 0.8607096820561632
Energy: 0.6481706744627701
Energy: 0.5190163126481451
Energy: 0.5493511966740869
Energy: 0.5370939177968713
Energy: 0.5447761999776505
Energy: 0.5477285532671189
Energy: 0.5367326000351907
Energy: 0.5906520699279676
Energy: 0.6096521608117105
Energy: 0.5806355179277588
Energy: 0.5908991668130432
Energy: 0.6111183306567584
Energy: 0.5850598552548886
Energy: 0.5863713278845902
Energy: 0.5359461547926
Energy: 0.5349160230504962
Energy: 0.5443800908466239
Energy: 0.5416495820768971
Energy: 0.5353622558694002
Energy: 0.5607054718937853
Energy: 0.5471470013611153
Energy: 0.5356926494072659
Energy: 0.5610739172192907
Energy: 0.5861296330378762
Energy: 0.5358903684826398
Energy: 0.5449564726269019
Energy: 0.5914958620050274
Energy: 0.5912991524722494
Energy: 0.5502688924731891
Energy: 0.5907465284467739
Energy: 0.5856878786019103
Energy: 0.5915898931044502
Energy: 0.5702382928763418
Energy: 0.528659246148119
Energy: 0.5926333882201794
Energy: 0.5592914055616828
Energy: 0.5910019908368416
Energy: 0.6236012348080923
Energy: 0.5493548411505682
Energy: 0.5361036653400068
Energy: 0.546822187341265
Energy: 0.5624762169440994
Energy: 0.5349955482698957
Energy: 0.5191006162827899
Energy: 0.5891246465031738
Energy: 0.6439613507252006
Energy: 0.5193905365439895
Energy: 0.5860074519434153
Energy: 0.646519718999718
Energy: 0.5191865335027788
Energy: 0.5853405810295883
Energy: 0.6437675429780774
Energy: 0.5194087182131581
Energy: 0.5909223753898463
Energy: 0.6102000980289088
Energy: 0.6232146004812779
Energy: 0.5486635563033483
Energy: 0.5358246264726424
Energy: 0.5469033540902148
Energy: 0.5455148111628804
Energy: 0.5350536551875328
Energy: 0.5852691248422385
Energy: 0.6102628181684222
Energy: 0.5403621280016114
Energy: 0.5858317419592839
Energy: 0.6107010356492282
Energy: 0.5847170474986987
Energy: 0.5443664727610968
Energy: 0.5496194017869848
Energy: 0.536475814958441
Energy: 0.5447039762205786
Energy: 0.5453967363277168
Energy: 0.5355602192681592
Energy: 0.5455233019898792
Energy: 0.5918536459924809
Energy: 0.5911780501332327
Energy: 0.6165542529644747
Energy: 0.5922055499444745
Energy: 0.5857805878693222
Energy: 0.591143131181932
Energy: 0.5636607085036317
Energy: 0.5380463188711162
Energy: 0.5912116706719611
Energy: 0.5601237473248459
Energy: 0.5353715094737266
Energy: 0.5911708701837164
Energy: 0.5641764175045552
Energy: 0.5205808681979227
Energy: 0.5917064924589495
Energy: 0.5601665123068049
Energy: 0.5856002587017772
Energy: 0.5190032404003988
Energy: 0.5485869207192197
Energy: 0.5371531155022695
Energy: 0.5192163810241218
Energy: 0.5448938837807503
Energy: 0.5362292028810648

minimum gb energy = 0.5190032404003988 eV
minimum distance =  2.69317976336031 Angstroms
sigma value = 9


========================================
theta = 148.41366190347208
========================================

Energy: 0.902881655391663
Energy: 0.6396739743978772
Energy: 0.6154689611131906
Energy: 0.5856764601359612
Energy: 0.6319335791529604
Energy: 0.61777187143434
Energy: 0.6008454697570363
Energy: 0.6028768000659066
Energy: 0.603891699731079
Energy: 0.5903483227090724
Energy: 0.5886763427293106
Energy: 0.5934347674775817
Energy: 0.6112849484784544
Energy: 0.5893344371850051
Energy: 0.6119054262399449
Energy: 0.6115997714000234
Energy: 0.5882499103879003
Energy: 0.6072548375003931
Energy: 0.5968387579309182
Energy: 0.5903735284783117
Energy: 0.6093577850135775
Energy: 0.597110040561897
Energy: 0.5902132641997362
Energy: 0.5914916073034088
Energy: 0.6202094091747798
Energy: 0.5819222183529035
Energy: 0.5705911136973557
Energy: 0.5695249648815629
Energy: 0.5980448172823064
Energy: 0.5696511314432082
Energy: 0.5981454748001436
Energy: 0.6000685448261598
Energy: 0.5985603439898358
Energy: 0.5989336722968436
Energy: 0.5961152418905525
Energy: 0.5983812146128276
Energy: 0.5936996272837064
Energy: 0.6000254589417287
Energy: 0.5946099272406175
Energy: 0.5921480879171054
Energy: 0.6008519096294582
Energy: 0.6032794146606293
Energy: 0.596536008268861
Energy: 0.5955292246724831
Energy: 0.5993297903430492
Energy: 0.5797468891692686
Energy: 0.5960795223039875
Energy: 0.5944154482475956
Energy: 0.689623790837831
Energy: 0.6064587778740712
Energy: 0.5777074757155733
Energy: 0.6025629588295797
Energy: 0.6041921666968024
Energy: 0.6047021106813008
Energy: 0.6039686558038299
Energy: 0.5812184885054923
Energy: 0.5775924868487188
Energy: 0.6024373425921805
Energy: 0.5794940097899207
Energy: 0.5697294931983512
Energy: 0.5972018829985505
Energy: 0.5696563479969262
Energy: 0.5709659998412626
Energy: 0.5796476702835218
Energy: 0.5999477200361583
Energy: 0.5708288467206423
Energy: 0.5974801695258087
Energy: 0.5913847799508581
Energy: 0.5941377326816055
Energy: 0.5883301848738165
Energy: 0.5916353082429634
Energy: 0.5969364750553873
Energy: 0.7344579461477894
Energy: 0.5880082228592021
Energy: 0.5809673985397574
Energy: 0.6051473879142797
Energy: 0.6136693048284124
Energy: 0.5966585897508861
Energy: 0.5883905223033159
Energy: 0.6005697062341534
Energy: 0.5905149842127195
Energy: 0.599755304658297
Energy: 0.5800667290708197
Energy: 0.591750492384975
Energy: 0.5974035763280644
Energy: 0.5695805825539537
Energy: 0.5930509892473416
Energy: 0.5977101922709662
Energy: 0.568835147758012
Energy: 0.5811602093544367
Energy: 0.6220455107867995
Energy: 0.6028021709906126
Energy: 0.5892446385563039
Energy: 0.6224000872650036
Energy: 0.6219525876581329
Energy: 0.5928777933590655
Energy: 0.589066398252946
Energy: 0.5904515423897846
Energy: 0.6082283037170646
Energy: 0.5885950563212005
Energy: 0.5994637034750737
Energy: 0.5908194499367321
Energy: 0.6772898086359013
Energy: 0.5909181240478673
Energy: 0.5790328881504023
Energy: 0.5915243773809642
Energy: 0.5897373806780667
Energy: 0.5713152345531368
Energy: 0.5884310852821149
Energy: 0.591581234119605
Energy: 0.5921623949894187
Energy: 0.588673773936092
Energy: 0.5798665428881163
Energy: 0.5930864936059332
Energy: 0.5889684594897125
Energy: 0.5913615214248058
Energy: 0.5918123232708302
Energy: 0.5894163591934177
Energy: 0.589996585813731
Energy: 0.5906325329535562
Energy: 0.5888165498124598
Energy: 0.5888374729192868
Energy: 0.5891212193614725
Energy: 0.59534799394955
Energy: 0.5918189355333844
Energy: 0.5945211089104028

minimum gb energy = 0.568835147758012 eV
minimum distance =  2.6704516117628 Angstroms
sigma value = 27


========================================
theta = 153.4746479833903
========================================

Energy: 0.7037645413065103
Energy: 0.644831564209965
Energy: 0.6408982406664575
Energy: 0.6526956990985915
Energy: 0.8467372349435759
Energy: 0.652858197956793
Energy: 0.5859590243728923
Energy: 0.5963472911450097
Energy: 0.5991567832613994
Energy: 0.5688683521098022
Energy: 0.6522562355351695
Energy: 0.5811969322217146
Energy: 0.5982281432283951
Energy: 0.5802138181101529
Energy: 0.5681578915464779
Energy: 0.5519962780911953
Energy: 0.601483025309772
Energy: 0.6047118179229621
Energy: 0.6126972214018593
Energy: 0.6252554727459501
Energy: 0.6206523785728228
Energy: 0.6157116264811134
Energy: 0.6279446841708222
Energy: 0.5804389541382138
Energy: 0.6126076177315873
Energy: 0.6226639510396215
Energy: 0.6145542964484118
Energy: 0.6131292483111804
Energy: 0.6221230804810417
Energy: 0.581570102582142
Energy: 0.6297030868879032
Energy: 0.5653235874816709
Energy: 0.5784259634856135
Energy: 0.6303735381311479
Energy: 0.621282858485193
Energy: 0.5790832641080444
Energy: 0.6301378126813211
Energy: 0.5871623675745156
Energy: 0.5867838922711668
Energy: 0.6311025378567939
Energy: 0.5870798760668495
Energy: 0.5874628417546498
Energy: 0.6391138594923689
Energy: 0.5942101690098714
Energy: 0.5932904941897689
Energy: 0.6245102253359827
Energy: 0.6093547715096588
Energy: 0.6426261632167988
Energy: 0.7125997392723368
Energy: 0.5467721086507711
Energy: 0.574514679177123
Energy: 0.5984142042751441
Energy: 0.618119929249768
Energy: 0.5369178006461596
Energy: 0.6105754502857048
Energy: 0.5514233542297696
Energy: 0.5460712510806934
Energy: 0.5928057344756613
Energy: 0.5735524590513229
Energy: 0.5451843676528028
Energy: 0.6245957775623446
Energy: 0.5734432073019864
Energy: 0.5678301524162499
Energy: 0.6244636945270501
Energy: 0.5692555752465571
Energy: 0.5726270576873633
Energy: 0.5386135158287758
Energy: 0.5359158989344274
Energy: 0.5376134728744687
Energy: 0.5392563118937779
Energy: 0.5367823406051027
Energy: 0.5381233896310427
Energy: 0.5674991949096528
Energy: 0.5362339961661582
Energy: 0.5369717072318237
Energy: 0.5685648896406723
Energy: 0.5367654436312532
Energy: 0.5383595244158045
Energy: 0.5677715930526722
Energy: 0.5397389779554783
Energy: 0.5392817491890355
Energy: 0.5683177741169038
Energy: 0.5368468693506576
Energy: 0.537308332359585
Energy: 0.5375668349710992
Energy: 0.5352652159957626
Energy: 0.5360034690472852
Energy: 0.5382968378858065
Energy: 0.5361676134863502
Energy: 0.5375469744884616
Energy: 0.6194742155385985
Energy: 0.5806210665587863
Energy: 0.5824538724163485
Energy: 0.6011795591576559
Energy: 0.5513213023001609
Energy: 0.5842672055497067
Energy: 0.6106564823266931
Energy: 0.5690867781681067
Energy: 0.5682852276707958
Energy: 0.6110393950382538
Energy: 0.5699993634480237
Energy: 0.5676766939127262
Energy: 0.6430388950589622
Energy: 0.5825088039311569
Energy: 0.5818234280735498
Energy: 0.6007618142672532
Energy: 0.6200920849879439
Energy: 0.5829455313318591
Energy: 0.6306598712078678
Energy: 0.5869466893542008
Energy: 0.5870787931518603
Energy: 0.6312737297195717
Energy: 0.5879125499813025
Energy: 0.5898493941027341
Energy: 0.5800180453212811
Energy: 0.5869593584819943
Energy: 0.5873097636092465
Energy: 0.5800795959338834
Energy: 0.5879193193303575
Energy: 0.5878327856121732
Energy: 0.7045591731122124
Energy: 0.6143334665927571
Energy: 0.6179330233066227
Energy: 0.6222874862297183
Energy: 0.6183119604503182
Energy: 0.5810699662922365
Energy: 0.6078249976737597
Energy: 0.6281202383604172
Energy: 0.6269897598314738
Energy: 0.6082867615057667
Energy: 0.6347300423592275
Energy: 0.6254934547719945
Energy: 0.626624859986757
Energy: 0.5660333695594217
Energy: 0.62331362421145
Energy: 0.6104920117043914
Energy: 0.5875325456639391
Energy: 0.6298360309046035
Energy: 0.5800393417080132
Energy: 0.6324482460692735
Energy: 0.6301468047588027
Energy: 0.5366300507626669
Energy: 0.635116964065141
Energy: 0.6233676401425416
Energy: 0.6381739667288083
Energy: 0.6845216690584366
Energy: 0.678892377727946
Energy: 0.6161348907548326
Energy: 0.6825798059025558
Energy: 0.575934798820276

minimum gb energy = 0.5352652159957626 eV
minimum distance =  2.69219005491971 Angstroms
sigma value = 19


========================================
theta = 157.15649268207542
========================================

Energy: 0.8641439027908231
Energy: 0.5637531227579297
Energy: 0.6809550339743282
Energy: 0.6608385062479889
Energy: 0.5860199268411309
Energy: 0.5785923772042135
Energy: 0.5831690084040195
Energy: 0.5798779166853882
Energy: 0.5803701455908246
Energy: 0.5803202389880083
Energy: 0.5831431652078357
Energy: 0.5813020188912993
Energy: 0.5933947016785563
Energy: 0.5829576876219825
Energy: 0.5763663130807541
Energy: 0.5908980788321184
Energy: 0.579642157335474
Energy: 0.5762581225192507
Energy: 0.5958012723101901
Energy: 0.6172625948875626
Energy: 0.5822543565670113
Energy: 0.5839568292707384
Energy: 0.5814302969711053
Energy: 0.5768860178058074
Energy: 0.6011951102664844
Energy: 0.5922813678061079
Energy: 0.5891720523492027
Energy: 0.6037038464940864
Energy: 0.5914949512522409
Energy: 0.5774547812077194
Energy: 0.596228801888715
Energy: 0.5805329769931116
Energy: 0.6228105254363873
Energy: 0.5832689513159218
Energy: 0.5806232009961462
Energy: 0.6173748401718836
Energy: 0.6000364814461666
Energy: 0.6027838787303518
Energy: 0.600908134739919
Energy: 0.5965168675969973
Energy: 0.6078203798622464
Energy: 0.6335088249145037
Energy: 0.6302290938202768
Energy: 0.5807379964692887
Energy: 0.5817142829551305
Energy: 0.6306783504638017
Energy: 0.5786787018507255
Energy: 0.58004515455314
Energy: 0.5909961160752885
Energy: 0.5840920941124557
Energy: 0.5876037565418141
Energy: 0.5930240950766913
Energy: 0.5911378436427132
Energy: 0.5823811717707613
Energy: 0.5916248742313994
Energy: 0.5935644134068898
Energy: 0.5943700364109674
Energy: 0.5799860713820546
Energy: 0.5939656008589924
Energy: 0.5855455086064218
Energy: 0.5906774271454356
Energy: 0.5616277677555234
Energy: 0.5613987893470417
Energy: 0.5910070536998648
Energy: 0.5753551285553238
Energy: 0.5820846402802838
Energy: 0.5829868860703545
Energy: 0.6108681472500292
Energy: 0.558214745150806
Energy: 0.5757393631290338
Energy: 0.6073891873517586
Energy: 0.5584158110809567
Energy: 0.6101037497803428
Energy: 0.5975170764101538
Energy: 0.5929367095443944
Energy: 0.5909651999469355
Energy: 0.5913303793180625
Energy: 0.5898519976049355
Energy: 0.6213883841344674
Energy: 0.5888686408777977
Energy: 0.5896371592182172
Energy: 0.5956283405620588
Energy: 0.5891510953160074
Energy: 0.5886644871111165
Energy: 0.5826831532844053
Energy: 0.561665335418329
Energy: 0.5656060223491698
Energy: 0.5833048719227905
Energy: 0.5795031465686646
Energy: 0.5589581485778374
Energy: 0.5826752879057112
Energy: 0.5597039958951614
Energy: 0.5583362740512303
Energy: 0.5785460648694981
Energy: 0.5835291325308375
Energy: 0.5625278342284399
Energy: 0.5971371365801456
Energy: 0.5923328617762141
Energy: 0.5893064665348321
Energy: 0.5809493749255513
Energy: 0.5967302222401999
Energy: 0.5887433182737479
Energy: 0.6185270264801517
Energy: 0.5657392554041273
Energy: 0.5658299058355937
Energy: 0.5889399122232399
Energy: 0.5796877455694093
Energy: 0.562290765659902
Energy: 0.5987919483826133
Energy: 0.5752935356874357
Energy: 0.5755427685608658
Energy: 0.5996747947874813
Energy: 0.6033874380176792
Energy: 0.5743849099993156
Energy: 0.5962020320123643
Energy: 0.5794561906824172
Energy: 0.578824849861669
Energy: 0.5783292311320438
Energy: 0.5856750993889616
Energy: 0.5824249997525239
Energy: 0.5791754348019401
Energy: 0.5658940762073885
Energy: 0.5656398021500346
Energy: 0.5800096615597597
Energy: 0.5810216343859148
Energy: 0.5585406359830326
Energy: 0.5894057239424287
Energy: 0.5614047156890426
Energy: 0.5616227021184971
Energy: 0.5778107456205759
Energy: 0.5696379560801935
Energy: 0.5582384981661455
Energy: 0.5975561029737785
Energy: 0.5820782053594337
Energy: 0.582382533451983
Energy: 0.5984066533784421
Energy: 0.582605897550203
Energy: 0.5774109612540437
Energy: 0.5945673720369504
Energy: 0.5798416564840676
Energy: 0.5738852010397154
Energy: 0.5951003011089643
Energy: 0.5774198617392055
Energy: 0.5807192265800167
Energy: 0.6128579011746843
Energy: 0.5617991308155
Energy: 0.5583951519811496
Energy: 0.5836914516686943
Energy: 0.584107523431768
Energy: 0.5580212941949882
Energy: 0.5994941112284642
Energy: 0.5805151573569121
Energy: 0.5738118945939861
Energy: 0.5910187140549681
Energy: 0.5794040672802091
Energy: 0.5742317823718607
Energy: 0.5936270499809337
Energy: 0.5795137973341575
Energy: 0.5831891581592668
Energy: 0.5911678501892018
Energy: 0.5790536452058609
Energy: 0.589635433267284
Energy: 0.5931830342359188
Energy: 0.5794511440290584
Energy: 0.5825748470703334
Energy: 0.5889074496882433
Energy: 0.5933082995223958
Energy: 0.58028268242133
Energy: 0.6201751798584768
Energy: 0.6307484209198011
Energy: 0.6322625550279035
Energy: 0.5734068275610175
Energy: 0.6301096209000506
Energy: 0.579481067541809

minimum gb energy = 0.5580212941949882 eV
minimum distance =  2.6860869011245 Angstroms
sigma value = 101


========================================
theta = 159.95002427584853
========================================

Energy: 0.8134906069354475
Energy: 0.5851726094688645
Energy: 0.5835831594016695
Energy: 0.5641267929163939
Energy: 0.5695311269746793
Energy: 0.5772621524941134
Energy: 0.6159253158785474
Energy: 0.5675305362245601
Energy: 0.5684057641507086
Energy: 0.606640593962292
Energy: 0.5745646092428127
Energy: 0.5768392944435079
Energy: 0.5903648704178689
Energy: 0.5784324570888582
Energy: 0.5688993303665975
Energy: 0.5833635848741646
Energy: 0.5678957914285382
Energy: 0.5679120480224055
Energy: 0.591591440783882
Energy: 0.5718792258284171
Energy: 0.5739960348498296
Energy: 0.5751739432297691
Energy: 0.5734681872938093
Energy: 0.5688804188192852
Energy: 0.5751104800333989
Energy: 0.5828292044218746
Energy: 0.5691967084791911
Energy: 0.5772080994579248
Energy: 0.5831639572819596
Energy: 0.5816765267376478
Energy: 0.5965096407453501
Energy: 0.5675167384103548
Energy: 0.5990454893906216
Energy: 0.6064556634978244
Energy: 0.5690184255112668
Energy: 0.5986005969170096
Energy: 0.5963285666076785
Energy: 0.5763096542565992
Energy: 0.5671524068452046
Energy: 0.5924981957654133
Energy: 0.565796297513789
Energy: 0.5667499046458131
Energy: 0.5870993159047767
Energy: 0.570495637111503
Energy: 0.574640633945413
Energy: 0.5853726183959826
Energy: 0.5873023462427599
Energy: 0.57569909329153
Energy: 0.5649432674616761
Energy: 0.5669586667762332
Energy: 0.568981474241344
Energy: 0.5663180876703913
Energy: 0.5829763851420873
Energy: 0.5754397412174482
Energy: 0.5635171087299421
Energy: 0.5702115428785308
Energy: 0.5790457306368472
Energy: 0.5672915901748122
Energy: 0.5697391798657888
Energy: 0.5742021154310716
Energy: 0.5849211628199769
Energy: 0.5464610072749037
Energy: 0.5670711913972749
Energy: 0.5841883859044139
Energy: 0.5466646126411875
Energy: 0.5765851157948303
Energy: 0.5893994873386564
Energy: 0.5734551958050704
Energy: 0.576193462310364
Energy: 0.5846968108081073
Energy: 0.5703899999848702
Energy: 0.5784133148047794
Energy: 0.5775533118135714
Energy: 0.5666144267377916
Energy: 0.5673266872032238
Energy: 0.5627044113055857
Energy: 0.5815199717904148
Energy: 0.5675636764405421
Energy: 0.5766395587205222
Energy: 0.5696624732830741
Energy: 0.570102925129084
Energy: 0.5644297617486964
Energy: 0.5694046707013115
Energy: 0.5780460513817368
Energy: 0.5887069834729213
Energy: 0.5694064460359511
Energy: 0.5745885183162281
Energy: 0.5840986795426701
Energy: 0.5674994978786473
Energy: 0.5776382536104269
Energy: 0.5891974815090797
Energy: 0.5719593358033732
Energy: 0.5738167988697173
Energy: 0.5799963696281445
Energy: 0.5713895978172473
Energy: 0.5681227397889029
Energy: 0.5754491599467366
Energy: 0.628169627419034
Energy: 0.5812949353403817
Energy: 0.5508960805312482
Energy: 0.6270975269412497
Energy: 0.5667383712262548
Energy: 0.6318079689719651
Energy: 0.5673314222819195
Energy: 0.5680079192235271
Energy: 0.5801284930043008
Energy: 0.5673897470006055
Energy: 0.5829928408626235
Energy: 0.5889099556615666
Energy: 0.5683745009526596
Energy: 0.5783368113204919
Energy: 0.583071667410605
Energy: 0.5673892462536961
Energy: 0.5690182093632293
Energy: 0.5904692436965987
Energy: 0.5686295628005201
Energy: 0.5738052436837571
Energy: 0.5669551174045472
Energy: 0.5674739454440196
Energy: 0.56896670017658
Energy: 0.5769365642740223
Energy: 0.5677298821141901
Energy: 0.5690260928350303
Energy: 0.5793390074036939
Energy: 0.5840268065418766
Energy: 0.5809832440260211
Energy: 0.5951619569218555
Energy: 0.5678496016568382
Energy: 0.5686624918739578
Energy: 0.596139998848479
Energy: 0.5667037075093913
Energy: 0.575319158772527
Energy: 0.5909328323912082
Energy: 0.5677705681011169
Energy: 0.5690481538818052
Energy: 0.5867262459099525
Energy: 0.5661551824266862
Energy: 0.5734229011900432
Energy: 0.6502031114282327
Energy: 0.5677196609832068
Energy: 0.5702345158395568
Energy: 0.6463409090773575
Energy: 0.5659272495820616
Energy: 0.64762229000241
Energy: 0.5689961939812088
Energy: 0.5674383371273463
Energy: 0.5682588180436623
Energy: 0.5665400728041622
Energy: 0.5666275724257354
Energy: 0.574278159695404
Energy: 0.5648170506718221
Energy: 0.5703591996128852
Energy: 0.5685748220122792
Energy: 0.5670187104410882
Energy: 0.5698214626724221
Energy: 0.5765196305236746
Energy: 0.5872694940514108
Energy: 0.5554459645479461
Energy: 0.5463447331112876
Energy: 0.5673735875604285
Energy: 0.5499268672273212
Energy: 0.5471168480744103
Energy: 0.5910854616702093
Energy: 0.5520956629426547
Energy: 0.5595238100043661
Energy: 0.583138052499871
Energy: 0.5492252041104391
Energy: 0.5801224994923375
Energy: 0.5767487919662191
Energy: 0.5805450925952472
Energy: 0.5696969956471252
Energy: 0.561338000058468
Energy: 0.5948259161090138
Energy: 0.5797821441351989
Energy: 0.57795572510269
Energy: 0.5681410099839801
Energy: 0.5754199873789221
Energy: 0.5644734631409798
Energy: 0.5672363605094657
Energy: 0.5675993272106213
Energy: 0.5896314134607124
Energy: 0.5685752003352208
Energy: 0.5747494765516238
Energy: 0.583040718447072
Energy: 0.5683254462719582
Energy: 0.5805936530580592
Energy: 0.5886287900383852
Energy: 0.5677838962494113
Energy: 0.5734861930817535
Energy: 0.5798374037203636
Energy: 0.5677039549593691
Energy: 0.5772462477721628
Energy: 0.5770951135111689
Energy: 0.5686289868558679
Energy: 0.547528171504855
Energy: 0.5474265447184987
Energy: 0.5643198668213258
Energy: 0.5497723653117488

minimum gb energy = 0.5463447331112876 eV
minimum distance =  2.64808892142089 Angstroms
sigma value = 33


========================================
theta = 180.0
========================================

Energy: 0.010223280090488935
Energy: 0.011680513847371553
Energy: 0.010595567603159163
Energy: 0.011552199346437496
Energy: 0.43524022661378003
Energy: 0.01053922724477844
Energy: 0.011264638789221482
Energy: 0.08230204938272805
Energy: 0.08186941455285911
Energy: 0.08260806076160006
Energy: 0.08334767137532975
Energy: 0.08156379491607275
Energy: 0.6584120433210963
Energy: 0.43484080266486597
Energy: 0.4340172356469316
Energy: 0.43337391538312725
Energy: 0.43490964835756435
Energy: 0.43403477880982627
Energy: 0.3034586267787593
Energy: 0.08230204938307906
Energy: 0.08186941455250812
Energy: 0.08260806076160006
Energy: 0.08334767137532975
Energy: 0.08156379491607275

minimum gb energy = 0.010223280090488935 eV
minimum distance =  2.83591435779881 Angstroms
sigma value = 1